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Search results for: '839-684-8'

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  1. 7-methylimidazo[1,2-a]pyridine-3-carboxylic acid
    Cas Number:  21801-80-9       EC Number: 839-884-5
    Formula:  C9H8N2O2
    Molecular weight:  176.18
    Synonyms:  WAA80180 | BXALETSPBUTZAS-UHFFFAOYSA-N | CS-0036489 | W16777 | Z1198158126 | SY040909 | 7-methyl-Imi...
    SMILES:  CC1=CC2=NC=C(N2C=C1)C(=O)O
    InChIKey:  BXALETSPBUTZAS-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H8N2O2/c1-6-2-3-11-7(9(12)13)5-10-8(11)4-6/h2-5H,1H3,(H,12,13)
  2. tert-butyl 3-azabicyclo[3.1.0]hexane-3-carboxylate
    Cas Number:  936551-50-7       EC Number: 839-386-8
    Formula:  C10H17NO2
    Molecular weight:  183.25
    Synonyms:  3-Aza-bicyclo[3.1.0]hexane-3-carboxylic acid tert-butyl ester | F88303 | SCHEMBL4224986 | SY214498 |...
    SMILES:  CC(C)(C)OC(=O)N1CC2CC2C1
    InChIKey:  GLWHHMBAMGJDAE-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H17NO2/c1-10(2,3)13-9(12)11-5-7-4-8(7)6-11/h7-8H,4-6H2,1-3H3
  3. 3-(3-Chloropropyl)-1,3-dihydro-7,8-dimethoxy-2H-3-benzazepin-2-one
    Cas Number:  85175-59-3       EC Number: ‘617-684-7
    Formula:  C15H18ClNO3
    Molecular weight:  295.76
    Synonyms:  1-(7,8-dimethoxy-1,3-dihydro-2H-3-benzazepin-2-on-3-yl) -3-chloro propane | 3-(3-Chloropropyl)-7,8-d...
    SMILES:  COC1=C(C=C2C=CN(C(=O)CC2=C1)CCCCl)OC
    InChIKey:  ODEZTTCXWTUAJT-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H18ClNO3/c1-19-13-8-11-4-7-17(6-3-5-16)15(18)10-12(11)9-14(13)20-2/h4,7-9H,3,5-6,10H2,1-2H3
  4. , Inhibitor of Sodium/potassium/calcium exchanger 6
    CGP 37157, Inhibitor of Sodium/potassium/calcium exchanger 6
    Cas Number:  75450-34-9       EC Number: 684-725-3
    Formula:  C15H11Cl2NOS
    Molecular weight:  324.2
    Synonyms:  7-chloro-5-(2-chlorophenyl)-1,5-dihydro-4,1-benzothiazepin-2-one | CM-119 | IDI1_034026 | Q27163475 ...
    SMILES:  C1C(=O)NC2=C(C=C(C=C2)Cl)C(S1)C3=CC=CC=C3Cl
    InChIKey:  KQEPIRKXSUIUTH-UHFFFAOYSA-N
    InChI:  InChI=1S/C15H11Cl2NOS/c16-9-5-6-13-11(7-9)15(20-8-14(19)18-13)10-3-1-2-4-12(10)17/h1-7,15H,8H2,(H,18,19)
  5. Tris(hydroxymethyl)aminomethane hydrochloride
    626 Citations
    Cas Number:  1185-53-1       EC Number: 214-684-5
    Formula:  C4H12CINO3
    Molecular weight:  157.6
    Synonyms:  Tris hydrochloride|Tris(hydroxymethyl)aminomethane hydrochloride|2-Amino-2-(hydroxymethyl)propane-1,...
    SMILES:  C(C(CO)(CO)N)O.Cl
    InChIKey:  QKNYBSVHEMOAJP-UHFFFAOYSA-N
    InChI:  InChI=1S/C4H11NO3.ClH/c5-4(1-6,2-7)3-8;/h6-8H,1-3,5H2;1H
  6. 3-(9H-fluoren-9-ylmethoxycarbonylamino)oxetane-3-carboxylic acid
    Cas Number:  1380327-56-9       EC Number: 839-675-9
    Formula:  C19H17NO5
    Molecular weight:  339.34
    Synonyms:  3-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)oxetane-3-carboxylicacid | 3-({[(9H-fluoren-9-yl)methox...
    SMILES:  C1C(CO1)(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
    InChIKey:  QUZXBKMAZQIBQR-UHFFFAOYSA-N
    InChI:  InChI=1S/C19H17NO5/c21-17(22)19(10-24-11-19)20-18(23)25-9-16-14-7-3-1-5-12(14)13-6-2-4-8-15(13)16/h1-8,16H,9-11H2,(H,20,23)(H,21,22)
  7. Aztreonam
    5 Citations
    Cas Number:  78110-38-0       EC Number: 278-839-9
    Formula:  C13H17N5O8S2
    Molecular weight:  435.43
    Synonyms:  BCP9000372 | DTXSID60203994 | HMS1568F11 | SCHEMBL290808 | SQ26776 | SQ-26776 | 1-NITROPYRENE (purit...
    SMILES:  CC1C(C(=O)N1S(=O)(=O)O)NC(=O)C(=NOC(C)(C)C(=O)O)C2=CSC(=N2)N
    InChIKey:  WZPBZJONDBGPKJ-VEHQQRBSSA-N
    InChI:  InChI=1S/C13H17N5O8S2/c1-5-7(10(20)18(5)28(23,24)25)16-9(19)8(6-4-27-12(14)15-6)17-26-13(2,3)11(21)22/h4-5,7H,1-3H3,(H2,14,15)(H,16,19)(H,21,22)(H,23,24,25)/b17-8-/t5-,7-/m0/s1
  8. tert-butyl 3-nitropiperidine-1-carboxylate
    Cas Number:  1313738-96-3       EC Number: 839-123-7
    Formula:  C10H18N2O4
    Molecular weight:  230.26
    Synonyms:  3-Nitropiperidine-1-carboxylic acid tert-butyl ester | AKOS015907492 | PS-15725 | DTXSID30693520 | E...
    SMILES:  CC(C)(C)OC(=O)N1CCCC(C1)[N+](=O)[O-]
    InChIKey:  GSYKFOZNUUEUBY-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H18N2O4/c1-10(2,3)16-9(13)11-6-4-5-8(7-11)12(14)15/h8H,4-7H2,1-3H3
  9. tert-butyl 6,6-difluoro-1,4-diazepane-1-carboxylate
    Cas Number:  1166820-07-0       EC Number: 839-527-3
    Formula:  C10H18N2O2F2
    Molecular weight:  236.25
    Synonyms:  EN300-1654216 | SCHEMBL2264531 | CS-0112801 | DTXSID50718845 | SY014262 | tert-butyl 6,6-difluoro-1,...
    SMILES:  CC(C)(C)OC(=O)N1CCNCC(C1)(F)F
    InChIKey:  QELRSCXQUXCUED-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H18F2N2O2/c1-9(2,3)16-8(15)14-5-4-13-6-10(11,12)7-14/h13H,4-7H2,1-3H3
  10. Ethyl 2-amino-4-methyl-5-(4-nitrophenyl)thiophene-3-carboxylate
    Cas Number:  174072-89-0       EC Number: ‘839-928-3
    Formula:  C14H14N2O4S
    Molecular weight:  306.34
    Synonyms:  2-AMINO-4-METHYL-5-(4-NITRO-PHENYL)-THIOPHENE-3-CARBOXYLIC ACID ETHYL ESTER | AB19854 | AMY27917 | E...
    SMILES:  CCOC(=O)C1=C(SC(=C1C)C2=CC=C(C=C2)[N+](=O)[O-])N
    InChIKey:  CXRJNUVDWUINBY-UHFFFAOYSA-N
    InChI:  InChI=1S/C14H14N2O4S/c1-3-20-14(17)11-8(2)12(21-13(11)15)9-4-6-10(7-5-9)16(18)19/h4-7H,3,15H2,1-2H3
  11. 1-(Difluoromethyl)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
    Cas Number:  1206640-82-5       EC Number: 839-936-7
    Formula:  C10H15BF2N2O2
    Molecular weight:  244.05
    Synonyms:  1-(difluoromethyl)-1h-pyrazole-4-boronic acid pinacol ester | EN300-317238 | MFCD17011852 | C10H15BF...
    SMILES:  B1(OC(C(O1)(C)C)(C)C)C2=CN(N=C2)C(F)F
    InChIKey:  SACVSUQLLHEZLY-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H15BF2N2O2/c1-9(2)10(3,4)17-11(16-9)7-5-14-15(6-7)8(12)13/h5-6,8H,1-4H3
  12. 6-Bromo-1-methyl-1H-benzo[d]imidazol-2(3H)-one
    Cas Number:  305790-48-1       EC Number: ‘839-001-3
    Formula:  C8H7BrN2O
    Molecular weight:  227.06
    Synonyms:  6-Bromo-1-methyl-1,3-dihydro-2H-benzo[d]imidazol-2-one | 1-methyl-6-bromo-1,3-dihydro-benzoimidazol-...
    SMILES:  CN1C2=C(C=CC(=C2)Br)NC1=O
    InChIKey:  WQXHBMNNVRGWHF-UHFFFAOYSA-N
    InChI:  InChI=1S/C8H7BrN2O/c1-11-7-4-5(9)2-3-6(7)10-8(11)12/h2-4H,1H3,(H,10,12)
  13. Tris(2-hydroxyethyl) Isocyanurate（THEIC）
    5 Citations
    Cas Number:  839-90-7
    Formula:  C9H15N3O6
    Molecular weight:  261.23
    Synonyms:  EINECS 212-660-9 | NSC-11680 | 1,3,5-Tris(2-hydroxyethyl)-1,3,5-triazinane-2,4,6-trione # | AC-11729...
    SMILES:  C(CO)N1C(=O)N(C(=O)N(C1=O)CCO)CCO
    InChIKey:  BPXVHIRIPLPOPT-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H15N3O6/c13-4-1-10-7(16)11(2-5-14)9(18)12(3-6-15)8(10)17/h13-15H,1-6H2
  14. 4,6-Dihydroxy-2-methylthiopyrimidine
    Cas Number:  1979-98-2       EC Number: 217-839-5
    Formula:  C5H6N2O2S
    Molecular weight:  158.18
    Synonyms:  2-Methylthio-5-fluoro-4,6-dihydroxypyrimidine | SDCCGMLS-0064589.P001 | 4,6-Dihydroxy-2-methylmercap...
    SMILES:  CSC1=NC(=CC(=O)N1)O
    InChIKey:  AEXCUJUYEZIWJV-UHFFFAOYSA-N
    InChI:  InChI=1S/C5H6N2O2S/c1-10-5-6-3(8)2-4(9)7-5/h2H,1H3,(H2,6,7,8,9)
  15. 4-Chloro-2-iodoaniline
    Cas Number:  63069-48-7       EC Number: 263-839-3
    Formula:  ClC6H3(I)NH2
    Molecular weight:  253.47
    Synonyms:  AKOS015855615 | C6H5ClIN | FT-0618025 | 4-chloro-2-iodobenzenamine | EN300-88613 | Benzenamine, 4-ch...
    SMILES:  C1=CC(=C(C=C1Cl)I)N
    InChIKey:  FLEJOBRWKBPUOX-UHFFFAOYSA-N
    InChI:  InChI=1S/C6H5ClIN/c7-4-1-2-6(9)5(8)3-4/h1-3H,9H2
  16. cis-2-tert-butoxycarbonyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-5-carboxylic acid
    Cas Number:  1069113-47-8       EC Number: 839-005-5
    Formula:  C13H21NO4
    Molecular weight:  255.31
    Synonyms:  AKOS025401013 | CAS-79-97-0 | cis-2-(tert-Butoxycarbonyl)octahydrocyclopenta[c]pyrrole-5-carboxylic ...
    SMILES:  CC(C)(C)OC(=O)N1CC2CC(CC2C1)C(=O)O
    InChIKey:  QGUILIYSENMTGT-PBINXNQUSA-N
    InChI:  InChI=1S/C13H21NO4/c1-13(2,3)18-12(17)14-6-9-4-8(11(15)16)5-10(9)7-14/h8-10H,4-7H2,1-3H3,(H,15,16)/t8?,9-,10+
  17. 2-{1-[(tert-butoxy)carbonyl]azetidin-3-yl}-2-fluoroacetic acid
    Cas Number:  1596752-15-6       EC Number: 839-125-8
    Formula:  C10H16FNO4
    Molecular weight:  233.24
    Synonyms:  MFCD28954161 | 2-{1-[(t-Butoxy)carbonyl]azetidin-3-yl}-2-fluoroacetic acid | D79599 | BS-43116 | 2-f...
    SMILES:  CC(C)(C)OC(=O)N1CC(C1)C(C(=O)O)F
    InChIKey:  JHUOTBNUINIFDO-UHFFFAOYSA-N
    InChI:  InChI=1S/C10H16FNO4/c1-10(2,3)16-9(15)12-4-6(5-12)7(11)8(13)14/h6-7H,4-5H2,1-3H3,(H,13,14)
  18. (1S,5S)-3-tert-butoxycarbonyl-3-azabicyclo[3.1.0]hexane-1-carboxylic acid
    Cas Number:  1931961-71-5       EC Number: 849-839-1
    Formula:  C11H17NO4
    Molecular weight:  227.26
    Synonyms:  (1S,5S)-3-(TERT-BUTOXYCARBONYL)-3-AZABICYCLO[3.1.0]HEXANE-1-CARBOXYLIC ACID | (1S,5S)-3-[(t-Butoxy)c...
    SMILES:  CC(C)(C)OC(=O)N1CC2CC2(C1)C(=O)O
    InChIKey:  OUTDFRNFTVGFRQ-RDDDGLTNSA-N
    InChI:  InChI=1S/C11H17NO4/c1-10(2,3)16-9(15)12-5-7-4-11(7,6-12)8(13)14/h7H,4-6H2,1-3H3,(H,13,14)/t7-,11-/m1/s1
  19. , Coagulation factor X inhibitor
    Apixaban, Coagulation factor X inhibitor
    1 Citations
    Cas Number:  503612-47-3       EC Number: 639-684-6
    Formula:  C25H25N5O4
    Molecular weight:  459.51
    Synonyms:  FT-0686944 | SCHEMBL118023 | 1H-PYRAZOLO(3,4-C)PYRIDINE-3-CARBOXAMIDE, 4,5,6,7-TETRAHYDRO-1-( 4-METH...
    SMILES:  COC1=CC=C(C=C1)N2C3=C(CCN(C3=O)C4=CC=C(C=C4)N5CCCCC5=O)C(=N2)C(=O)N
    InChIKey:  QNZCBYKSOIHPEH-UHFFFAOYSA-N
    InChI:  InChI=1S/C25H25N5O4/c1-34-19-11-9-18(10-12-19)30-23-20(22(27-30)24(26)32)13-15-29(25(23)33)17-7-5-16(6-8-17)28-14-3-2-4-21(28)31/h5-12H,2-4,13-15H2,1H3,(H2,26,32)
  20. 1,10-Phenanthroline-5,6-Dione
    3 Citations
    Cas Number:  27318-90-7       EC Number: 627-684-9
    Formula:  C12H6N2O2
    Molecular weight:  210.19
    Synonyms:  5,6-dihydro-1,10-phenanthroline-5,6-dione | cid_72810 | Mepentamate | SR-01000899541 | NSC 346882 | ...
    SMILES:  C1=CC2=C(C3=C(C=CC=N3)C(=O)C2=O)N=C1
    InChIKey:  KCALAFIVPCAXJI-UHFFFAOYSA-N
    InChI:  InChI=1S/C12H6N2O2/c15-11-7-3-1-5-13-9(7)10-8(12(11)16)4-2-6-14-10/h1-6H
  21. , Inhibitor of cyclin dependent kinase 6;Inhibitor of cyclin dependent kinase 7;Inhibitor of glycogen synthase kinase 3 beta
    Cdk/Crk inhibitor, Inhibitor of cyclin dependent kinase 6;Inhibitor of cyclin dependent kinase 7;Inhibitor of glycogen synthase kinase 3 beta
    Cas Number:  784211-09-2
    Formula:  C23H22Cl2N4O3
    Molecular weight:  473.4
    Synonyms:  Q27075833 | SCHEMBL1179657 | Prednidib | HMS3229E20 | DTXSID60429556 | 1-(2,6-dichlorophenyl)-6-{[4-...
    SMILES:  CC(C)C1=NN(C2=C1C(=O)NC(=N2)CC3=CC=C(C=C3)OCCO)C4=C(C=CC=C4Cl)Cl
    InChIKey:  RSQPNXBTPUXMQN-UHFFFAOYSA-N
    InChI:  InChI=1S/C23H22Cl2N4O3/c1-13(2)20-19-22(29(28-20)21-16(24)4-3-5-17(21)25)26-18(27-23(19)31)12-14-6-8-15(9-7-14)32-11-10-30/h3-9,13,30H,10-12H2,1-2H3,(H,26,27,31)
  22. (1R,5R)-3-tert-butoxycarbonyl-3-azabicyclo[3.1.0]hexane-1-carboxylic acid
    Cas Number:  1165450-63-4       EC Number: 849-839-1, 866-368-7
    Formula:  C11H17NO4
    Molecular weight:  227.26
    Synonyms:  (1R,5R)-3-(tert-Butoxycarbonyl)-3-azabicyclo[3.1.0]hexane-1-carboxylicacid | CS-0058126 | WS-01660 |...
    SMILES:  CC(C)(C)OC(=O)N1CC2CC2(C1)C(=O)O
    InChIKey:  OUTDFRNFTVGFRQ-CPCISQLKSA-N
    InChI:  InChI=1S/C11H17NO4/c1-10(2,3)16-9(15)12-5-7-4-11(7,6-12)8(13)14/h7H,4-6H2,1-3H3,(H,13,14)/t7-,11-/m0/s1
  23. rel-(3aR,5s,6aS)-2-tert-butoxycarbonyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-5-carboxylic acid
    Cas Number:  1401464-09-2       EC Number: 839-005-5
    Formula:  C13H21NO4
    Molecular weight:  255.31
    Synonyms:  AKOS025401013 | CAS-79-97-0 | cis-2-(tert-Butoxycarbonyl)octahydrocyclopenta[c]pyrrole-5-carboxylic ...
    SMILES:  CC(C)(C)OC(=O)N1CC2CC(CC2C1)C(=O)O
    InChIKey:  QGUILIYSENMTGT-PBINXNQUSA-N
    InChI:  InChI=1S/C13H21NO4/c1-13(2,3)18-12(17)14-6-9-4-8(11(15)16)5-10(9)7-14/h8-10H,4-7H2,1-3H3,(H,15,16)/t8?,9-,10+
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