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Search results for: '111-01-3'
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1,2-Dibromo-3-chloropropane
Formula: C3H5Br2ClMolecular weight: 236.33Synonyms: HSDB 1629 | C0806 | Gro-Tone Nematode Granular | Nemagon 20G | Nematocide | 1,2-DIBROMO-3-CHLOROPROP...SMILES: C(C(CBr)Br)ClInChIKey: WBEJYOJJBDISQU-UHFFFAOYSA-NInChI: InChI=1S/C3H5Br2Cl/c4-1-3(5)2-6/h3H,1-2H2
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(S)-(−)-Thalidomide
Cas Number: 841-67-8Formula: C13H10N2O4Molecular weight: 258.23Synonyms: 2-[(3S)-2,6-bis(oxidanylidene)piperidin-3-yl]isoindole-1,3-dione | EN300-7507076 | NCGC00015989-01 |...SMILES: C1CC(=O)NC(=O)C1N2C(=O)C3=CC=CC=C3C2=OInChIKey: UEJJHQNACJXSKW-VIFPVBQESA-NInChI: InChI=1S/C13H10N2O4/c16-10-6-5-9(11(17)14-10)15-12(18)7-3-1-2-4-8(7)13(15)19/h1-4,9H,5-6H2,(H,14,16,17)/t9-/m0/s1
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Acenaphthene
Formula: C12H10Molecular weight: 154.21Synonyms: MFCD00003807 | NSC7657 | NSC-7657 | Q415103 | Acenaphthene Zone Refined (number of passes:30) | D976...SMILES: C1CC2=CC=CC3=C2C1=CC=C3InChIKey: CWRYPZZKDGJXCA-UHFFFAOYSA-NInChI: InChI=1S/C12H10/c1-3-9-4-2-6-11-8-7-10(5-1)12(9)11/h1-6H,7-8H2
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HG-9-91-01, Inhibitor of salt inducible kinase 1;Inhibitor of salt inducible kinase 2;Inhibitor of SIK family kinase 3
Cas Number: 1456858-58-4Formula: C32H37N7O3Molecular weight: 567.68Synonyms: BCP25041 | DTXSID401025699 | SCHEMBL15271960 | SIK inhibitor 1 | HG-9-91-01 (1) | MS-30272 | 1-(2,4-...SMILES: CC1=C(C(=CC=C1)C)NC(=O)N(C2=C(C=C(C=C2)OC)OC)C3=NC=NC(=C3)NC4=CC=C(C=C4)N5CCN(CC5)CInChIKey: UYUHRKLITDJEHB-UHFFFAOYSA-NInChI: See more
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ZM 241385, Antagonist of A 1 receptor;Antagonist of A 2A receptor;Antagonist of A 2B receptor;Antagonist of A 3 receptor
Cas Number: 139180-30-6Formula: C16H15N7O2Molecular weight: 337.34Synonyms: C16H15N7O2 | CHEBI:92361 | DB08770 | 5NIC36BO71 | GTPL405 | NCGC00024955-01 | BRD-K19605405-001-01-9...SMILES: C1=COC(=C1)C2=NN3C(=NC(=NC3=N2)NCCC4=CC=C(C=C4)O)NInChIKey: PWTBZOIUWZOPFT-UHFFFAOYSA-NInChI: InChI=1S/C16H15N7O2/c17-14-20-15(18-8-7-10-3-5-11(24)6-4-10)21-16-19-13(22-23(14)16)12-2-1-9-25-12/h1-6,9,24H,7-8H2,(H3,17,18,19,20,21,22)
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Garenoxacin
Cas Number: 194804-75-6Formula: C23H20F2N2O4Molecular weight: 426.41Synonyms: DB06160 | DTXSID30173135 | J-012614 | NCGC00015524-01 | Garenfloxacin | Garenoxacin [INN:BAN] | EX-A...SMILES: CC1C2=C(CN1)C=C(C=C2)C3=C(C4=C(C=C3)C(=O)C(=CN4C5CC5)C(=O)O)OC(F)FInChIKey: NJDRXTDGYFKORP-LLVKDONJSA-NInChI: InChI=1S/C23H20F2N2O4/c1-11-15-5-2-12(8-13(15)9-26-11)16-6-7-17-19(21(16)31-23(24)25)27(14-3-4-14)10-18(20(17)28)22(29)30/h2,5-8,10-11,14,23,26H,3-4,9H2,1H3,(H,29,30)/t11-/m1/s1
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trans-2-Heptenal
Cas Number: 18829-55-5Formula: C7H12OMolecular weight: 112.17Synonyms: 3-Butylacrolein | trans-2-Hepten-1-al | DTXSID4062436 | Hept-2(E)-enal | Heptenal, (E)- | (E)-2-Hept...SMILES: CCCCC=CC=OInChIKey: NDFKTBCGKNOHPJ-AATRIKPKSA-NInChI: InChI=1S/C7H12O/c1-2-3-4-5-6-7-8/h5-7H,2-4H2,1H3/b6-5+
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3-(benzenesulfonyl)pyrrolidine hydrochloride
Cas Number: 1003562-01-3Formula: C10H14ClNO2SMolecular weight: 247.74Synonyms: 1003562-01-3|3-(Phenylsulfonyl)pyrrolidine hydrochloride|3-(benzenesulfonyl)pyrrolidine hydrochlorid...SMILES: C1CNCC1S(=O)(=O)C2=CC=CC=C2.ClInChIKey: MUMXFWPSGKJXFA-UHFFFAOYSA-NInChI: InChI=1S/C10H13NO2S.ClH/c12-14(13,10-6-7-11-8-10)9-4-2-1-3-5-9;/h1-5,10-11H,6-8H2;1H
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(3-Bromo-2,5-dimethoxy-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl)methanamine
Formula: C11H14BrNO2Molecular weight: 272.14Synonyms: TCB-2 | (3-bromo-2,5-dimethoxy-7-bicyclo[4.2.0]octa-1(6),2,4-trienyl)methanamine | CHEBI:91625 | BDB...SMILES: COC1=CC(=C(C2=C1C(C2)CN)OC)BrInChIKey: MPBCKKVERDTCEL-UHFFFAOYSA-NInChI: InChI=1S/C11H14BrNO2/c1-14-9-4-8(12)11(15-2)7-3-6(5-13)10(7)9/h4,6H,3,5,13H2,1-2H3
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2-Bromopropane
Formula: C3H7BrMolecular weight: 122.99Synonyms: NCGC00257910-01 | AKOS000119846 | InChI=1/C3H7Br/c1-3(2)4/h3H,1-2H | NCGC00091451-01 | STL146524 | 1...SMILES: CC(C)BrInChIKey: NAMYKGVDVNBCFQ-UHFFFAOYSA-NInChI: InChI=1S/C3H7Br/c1-3(2)4/h3H,1-2H3
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Vidofludimus, Dihydroorotate dehydrogenase inhibitor
Cas Number: 717824-30-1Formula: C20H18FNO4Molecular weight: 355.36Synonyms: EX-A4148 | s7262 | (+/-) ethylnipecotate | 2,2'-Anhydro(1.beta.-D-arabinofuranosyl)uracil | NCGC0024...SMILES: COC1=CC=CC(=C1)C2=CC(=C(C=C2)NC(=O)C3=C(CCC3)C(=O)O)FInChIKey: XPRDUGXOWVXZLL-UHFFFAOYSA-NInChI: InChI=1S/C20H18FNO4/c1-26-14-5-2-4-12(10-14)13-8-9-18(17(21)11-13)22-19(23)15-6-3-7-16(15)20(24)25/h2,4-5,8-11H,3,6-7H2,1H3,(H,22,23)(H,24,25)
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EMD 386088
Cas Number: 54635-62-0Formula: C14H15ClN2Molecular weight: 246.74Synonyms: BDBM50171235 | EMD-386088 | GTPL8428 | BRD-K47659338-003-01-0 | compound 18 [PMID 16055331] | NCGC00...SMILES: CC1=C(C2=C(N1)C=CC(=C2)Cl)C3=CCNCC3InChIKey: BPPGPYJBCVXILI-UHFFFAOYSA-NInChI: InChI=1S/C14H15ClN2/c1-9-14(10-4-6-16-7-5-10)12-8-11(15)2-3-13(12)17-9/h2-4,8,16-17H,5-7H2,1H3
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DH 97, Antagonist of MT 2 receptor
Cas Number: 220339-00-4Formula: C22H26N2OMolecular weight: 334.46Synonyms: N-pentanoyl 2-benzyltryptamine | Q27077041 | HMS3267D11 | Pentanoic acid [2-(2-benzyl-1H-indol-3-yl)...SMILES: CCCCC(=O)NCCC1=C(NC2=CC=CC=C21)CC3=CC=CC=C3InChIKey: HDOIPCLEKCEANF-UHFFFAOYSA-NInChI: InChI=1S/C22H26N2O/c1-2-3-13-22(25)23-15-14-19-18-11-7-8-12-20(18)24-21(19)16-17-9-5-4-6-10-17/h4-12,24H,2-3,13-16H2,1H3,(H,23,25)
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IC 261, Inhibitor of casein kinase 1 alpha 1;Inhibitor of casein kinase 1 delta;Inhibitor of casein kinase 1 epsilon
Cas Number: 186611-52-9Formula: C18H17NO4Molecular weight: 311.34Synonyms: NCGC00015546-02 | NCGC00015546-03 | HMS3229I10 | IDI1_012141 | Lopac0_001017 | SR-01000075566 | ic26...SMILES: COC1=CC(=C(C(=C1)OC)C=C2C3=CC=CC=C3NC2=O)OCInChIKey: JBJYTZXCZDNOJW-JLHYYAGUSA-NInChI: InChI=1S/C18H17NO4/c1-21-11-8-16(22-2)14(17(9-11)23-3)10-13-12-6-4-5-7-15(12)19-18(13)20/h4-10H,1-3H3,(H,19,20)/b13-10+
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Tenidap, Activator of K ir2.3
Cas Number: 120210-48-2Formula: C14H9N2O3SClMolecular weight: 320.75Synonyms: BDBM50331888 | 5-chloro-2-hydroxy-3-(thiophene-2-carbonyl)indole-1-carboxamide | (Z)-5-chloro-3-(hyd...SMILES: C1=CSC(=C1)C(=O)C2=C(N(C3=C2C=C(C=C3)Cl)C(=O)N)OInChIKey: IZSFDUMVCVVWKW-UHFFFAOYSA-NInChI: InChI=1S/C14H9ClN2O3S/c15-7-3-4-9-8(6-7)11(13(19)17(9)14(16)20)12(18)10-2-1-5-21-10/h1-6,19H,(H2,16,20)
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2-Ethylhexyl 4-Hydroxybenzoate
Cas Number: 5153-25-3Formula: C15H22O3Molecular weight: 250.34Synonyms: 2-Ethylhexyl4-hydroxybenzoate | 2-ethylhexyl 4-hydroxybenzoate, AldrichCPR | CHEBI:34274 | NCGC00249...SMILES: CCCCC(CC)COC(=O)C1=CC=C(C=C1)OInChIKey: VTIMKVIDORQQFA-UHFFFAOYSA-NInChI: InChI=1S/C15H22O3/c1-3-5-6-12(4-2)11-18-15(17)13-7-9-14(16)10-8-13/h7-10,12,16H,3-6,11H2,1-2H3
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4-chloro-d-phenylalanine
Cas Number: 14091-08-8Formula: C9H10ClNO2Synonyms: EN300-366578 | NCGC00024889-01 | P-CHLORO-D-PHENYLALANINE | RSS1JQ7MES | AM82750 | AKOS016842281 | F...SMILES: C1=CC(=CC=C1CC(C(=O)O)N)ClInChIKey: NIGWMJHCCYYCSF-MRVPVSSYSA-NInChI: InChI=1S/C9H10ClNO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13/h1-4,8H,5,11H2,(H,12,13)/t8-/m1/s1
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4-(Benzyloxy)-4-oxobutanoic acid
Cas Number: 103-40-2Formula: C11H12O4Molecular weight: 208.21Synonyms: Succinic acid mono benzyl ester | NCGC00175200-01 | 3-(benzyloxycarbonyl)propanoic acid | UNII-R1X14...SMILES: C1=CC=C(C=C1)COC(=O)CCC(=O)OInChIKey: UGUBQKZSNQWWEV-UHFFFAOYSA-NInChI: InChI=1S/C11H12O4/c12-10(13)6-7-11(14)15-8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13)
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L-694247, Agonist of 5-HT 1A receptor;Agonist of 5-HT 1B receptor;Agonist of 5-HT 1D receptor
Cas Number: 137403-12-4Formula: C20H21N5O3SMolecular weight: 411.49Synonyms: N-[4-[[5-[3-(2-aminoethyl)-1H-indol-5-yl]-1,2,4-oxadiazol-3-yl]methyl]phenyl]methanesulfonamide | Or...SMILES: CS(=O)(=O)NC1=CC=C(C=C1)CC2=NOC(=N2)C3=CC4=C(C=C3)NC=C4CCNInChIKey: HKXMQLISPYELRD-UHFFFAOYSA-NInChI: InChI=1S/C20H21N5O3S/c1-29(26,27)25-16-5-2-13(3-6-16)10-19-23-20(28-24-19)14-4-7-18-17(11-14)15(8-9-21)12-22-18/h2-7,11-12,22,25H,8-10,21H2,1H3
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PF 750, Inhibitor of epoxide hydrolase 2;Inhibitor of Fatty acid amide hydrolase
Cas Number: 959151-50-9Formula: C22H23N3OMolecular weight: 345.44Synonyms: NCGC00370873-01 | Q27088336 | N-phenyl-4-(quinolin-3-ylmethyl)piperidine-1-carboxamide | BDBM26740 |...SMILES: C1CN(CCC1CC2=CC3=CC=CC=C3N=C2)C(=O)NC4=CC=CC=C4InChIKey: BIODYGOZWZNCAG-UHFFFAOYSA-NInChI: InChI=1S/C22H23N3O/c26-22(24-20-7-2-1-3-8-20)25-12-10-17(11-13-25)14-18-15-19-6-4-5-9-21(19)23-16-18/h1-9,15-17H,10-14H2,(H,24,26)
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M77976
Cas Number: 394237-61-7Formula: C17H16N2O3Molecular weight: 296.32Synonyms: MS-24247 | PDHK RIKEN | Q27097572 | SMR003240242 | SR-01000443979 | AKOS002164191 | NCGC00263231-01 ...SMILES: CC1=C(C(=NN1)C2=C(C=C(C=C2)O)O)C3=CC=C(C=C3)OCInChIKey: GSBFARPNIZUMHA-UHFFFAOYSA-NInChI: InChI=1S/C17H16N2O3/c1-10-16(11-3-6-13(22-2)7-4-11)17(19-18-10)14-8-5-12(20)9-15(14)21/h3-9,20-21H,1-2H3,(H,18,19)
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methyl cis-3-aminocyclohexane-1-carboxylate hydrochloride
Cas Number: 87360-22-3Formula: C8H15NO2•HClSynonyms: H-1,3-CIS-ACHC-OME HCL | 87360-22-3 | 1415825-01-2 | (1R,3S)-Methyl 3-aminocyclohexanecarboxylate hy...SMILES: COC(=O)C1CCCC(C1)N.ClInChIKey: OOFXENVWECZJBF-HHQFNNIRSA-NInChI: InChI=1S/C8H15NO2.ClH/c1-11-8(10)6-3-2-4-7(9)5-6;/h6-7H,2-5,9H2,1H3;1H/t6-,7+;/m1./s1
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