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Search results for: '23235-61-2'
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4-acetylpiperazin-2-one
Cas Number: 17796-61-1Formula: C6H10N2O2Molecular weight: 142.158Synonyms: 4-acetylpiperazin-2-one|17796-61-1|4-acetyl-2-Piperazinone|4-Acetyl-Piperazin-2-One|2-Piperazinone, ...SMILES: CC(=O)N1CCNC(=O)C1InChIKey: ISNPMTVERREURB-UHFFFAOYSA-NInChI: InChI=1S/C6H10N2O2/c1-5(9)8-3-2-7-6(10)4-8/h2-4H2,1H3,(H,7,10)
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Thymolblue
Formula: C27H30O5SMolecular weight: 466.59Synonyms: Thymol blue|76-61-9|Thymolsulfonephthalein|Thymolsulfophthalein|Thymosulfonphthalein|Thymolsulfonpht...SMILES: CC1=CC(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)OInChIKey: PRZSXZWFJHEZBJ-UHFFFAOYSA-NInChI: InChI=1S/C27H30O5S/c1-15(2)19-13-22(17(5)11-24(19)28)27(21-9-7-8-10-26(21)33(30,31)32-27)23-14-20(16(3)4)25(29)12-18(23)6/h7-16,28-29H,1-6H3
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Mefexamide hydrochloride
Cas Number: 1227-61-8Formula: C15H24N2O3·HClMolecular weight: 316.82Synonyms: mefexamide|Timodyne|1227-61-8|Mefexadyne|Mefaxadyne|N-[2-(diethylamino)ethyl]-2-(4-methoxyphenoxy)ac...SMILES: CCN(CC)CCNC(=O)COC1=CC=C(C=C1)OCInChIKey: HUNIPYLVUPMFCZ-UHFFFAOYSA-NInChI: InChI=1S/C15H24N2O3/c1-4-17(5-2)11-10-16-15(18)12-20-14-8-6-13(19-3)7-9-14/h6-9H,4-5,10-12H2,1-3H3,(H,16,18)
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5-bromo-2-(trifluoromethyl)pyrimidin-4-amine
Cas Number: 1379352-61-0Formula: C5H3N3F3BrMolecular weight: 242Synonyms: SY248842 | P19405 | DTXSID60856969 | MFCD11043793 | AS-79452 | 5-Bromo-2-(trifluoromethyl)pyrimidin-...SMILES: C1=C(C(=NC(=N1)C(F)(F)F)N)BrInChIKey: DZWBVYLQAPRBOZ-UHFFFAOYSA-NInChI: InChI=1S/C5H3BrF3N3/c6-2-1-11-4(5(7,8)9)12-3(2)10/h1H,(H2,10,11,12)
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2-(Benzyloxy)-1-chloro-4-nitrobenzene
Cas Number: 76464-61-4Formula: C13H10ClNO3Molecular weight: 263.7Synonyms: 2-(Benzyloxy)-1-chloro-4-nitrobenzene|76464-61-4|1-chloro-4-nitro-2-phenylmethoxybenzene|SCHEMBL9441...SMILES: C1=CC=C(C=C1)COC2=C(C=CC(=C2)[N+](=O)[O-])ClInChIKey: DXQRYHUPOMREGK-UHFFFAOYSA-NInChI: InChI=1S/C13H10ClNO3/c14-12-7-6-11(15(16)17)8-13(12)18-9-10-4-2-1-3-5-10/h1-8H,9H2
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5-Bromo-4-methoxy-2-methylpyridine
Cas Number: 886372-61-8Formula: C7H8BrNOMolecular weight: 202.05Synonyms: 5-Bromo-4-methoxy-2-methylpyridine|886372-61-8|5-Bromo-4-methoxy-2-methyl-pyridine|MFCD07374958|SCHE...SMILES: CC1=CC(=C(C=N1)Br)OCInChIKey: LSMZCZITQBBZGO-UHFFFAOYSA-NInChI: InChI=1S/C7H8BrNO/c1-5-3-7(10-2)6(8)4-9-5/h3-4H,1-2H3
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(2S,4S)-1-tert-butoxycarbonyl-4-(difluoromethoxymethyl)pyrrolidine-2-carboxylic acid
Cas Number: 1378389-61-7Formula: C12H19NO5F2Molecular weight: 295.28Synonyms: 1378389-61-7 | (2S,4S)-1-(tert-butoxycarbonyl)-4-((difluoromethoxy)methyl)pyrrolidine-2-carboxylic a...SMILES: CC(C)(C)OC(=O)N1CC(CC1C(=O)O)COC(F)FInChIKey: MVSMHEQSPFMSKF-YUMQZZPRSA-NInChI: InChI=1S/C12H19F2NO5/c1-12(2,3)20-11(18)15-5-7(6-19-10(13)14)4-8(15)9(16)17/h7-8,10H,4-6H2,1-3H3,(H,16,17)/t7-,8-/m0/s1
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5-iodo-2-methyl-1,3-benzothiazole
Cas Number: 90414-61-2Formula: C8H6INSMolecular weight: 275.11Synonyms: 90414-61-2|5-Iodo-2-methyl-1,3-benzothiazole|5-Iodo-2-methylbenzo[d]thiazole|5-iodo-2-methylbenzothi...SMILES: CC1=NC2=C(S1)C=CC(=C2)IInChIKey: UUODOEGHZZBDBL-UHFFFAOYSA-NInChI: InChI=1S/C8H6INS/c1-5-10-7-4-6(9)2-3-8(7)11-5/h2-4H,1H3
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1,1-diethyl 3-oxocyclobutane-1,1-dicarboxylate
Cas Number: 99173-61-2Formula: C10H14O5Molecular weight: 214.217Synonyms: 1,1-Diethyl 3-oxocyclobutane-1,1-dicarboxylate|99173-61-2|diethyl 3-oxocyclobutane-1,1-dicarboxylate...SMILES: CCOC(=O)C1(CC(=O)C1)C(=O)OCCInChIKey: RNEYQVYRVAVAIF-UHFFFAOYSA-NInChI: InChI=1S/C10H14O5/c1-3-14-8(12)10(5-7(11)6-10)9(13)15-4-2/h3-6H2,1-2H3
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Besifloxacin HCl, Bacterial DNA gyrase inhibitor
Cas Number: 405165-61-9Formula: C19H21ClFN3O3.HClMolecular weight: 430.3Synonyms: CCG-221259 | 1398566-43-2 | D08872 | DTXSID30304068 | A848253 | AKOS025401618 | Besifloxacin hydroch...SMILES: C1CCN(CC(C1)N)C2=C(C=C3C(=C2Cl)N(C=C(C3=O)C(=O)O)C4CC4)F.ClInChIKey: PMQBICKXAAKXAY-HNCPQSOCSA-NInChI: InChI=1S/C19H21ClFN3O3.ClH/c20-15-16-12(18(25)13(19(26)27)9-24(16)11-4-5-11)7-14(21)17(15)23-6-2-1-3-10(22)8-23;/h7,9-11H,1-6,8,22H2,(H,26,27);1H/t10-;/m1./s1
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GLPG2451
Cas Number: 2055015-61-5Formula: C16H16F3N3O5SMolecular weight: 419.38Synonyms: AKOS040740795 | 2055015-61-5 | 3-amino-N-[(2S)-2-hydroxypropyl]-5-[4-(trifluoromethoxy)phenyl]sulfon...SMILES: CC(CNC(=O)C1=C(C=C(C=N1)S(=O)(=O)C2=CC=C(C=C2)OC(F)(F)F)N)OInChIKey: UMOGNCVNHXWFIX-VIFPVBQESA-NInChI: InChI=1S/C16H16F3N3O5S/c1-9(23)7-22-15(24)14-13(20)6-12(8-21-14)28(25,26)11-4-2-10(3-5-11)27-16(17,18)19/h2-6,8-9,23H,7,20H2,1H3,(H,22,24)/t9-/m0/s1
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Methyl cyclohexylacetate
Cas Number: 14352-61-5Formula: C6H11CH2CO2CH3Molecular weight: 156.22Synonyms: methyl 2-cyclohexylacetate|14352-61-5|Methyl cyclohexylacetate|Methylcyclohexylacetate|Methyl cycloh...SMILES: COC(=O)CC1CCCCC1InChIKey: IMXBRVLCKXGWSS-UHFFFAOYSA-NInChI: InChI=1S/C9H16O2/c1-11-9(10)7-8-5-3-2-4-6-8/h8H,2-7H2,1H3
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benzyl 2,9-diazaspiro[5.5]undecane-2-carboxylate
Cas Number: 1086394-61-7Formula: C17H24N2O2Molecular weight: 288.391Synonyms: BENZYL 2,9-DIAZASPIRO[5.5]UNDECANE-2-CARBOXYLATE|1086394-61-7|2-Cbz-2,9-diazaspiro[5.5]undecane|MFCD...SMILES: C1CC2(CCNCC2)CN(C1)C(=O)OCC3=CC=CC=C3InChIKey: ZEIFMAOPUIBSJN-UHFFFAOYSA-NInChI: InChI=1S/C17H24N2O2/c20-16(21-13-15-5-2-1-3-6-15)19-12-4-7-17(14-19)8-10-18-11-9-17/h1-3,5-6,18H,4,7-14H2
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2-(diphenylmethyl)-2,6-diazaspiro[3.4]octane
Cas Number: 1250443-61-8Formula: C19H22N2Molecular weight: 278.399Synonyms: 1250443-61-8|2-(DIPHENYLMETHYL)-2,6-DIAZASPIRO[3.4]OCTANE|2-Benzhydryl-2,6-diazaspiro[3.4]octane|2-b...SMILES: C1CNCC12CN(C2)C(C3=CC=CC=C3)C4=CC=CC=C4InChIKey: SYMQBAASXLKRNK-UHFFFAOYSA-NInChI: InChI=1S/C19H22N2/c1-3-7-16(8-4-1)18(17-9-5-2-6-10-17)21-14-19(15-21)11-12-20-13-19/h1-10,18,20H,11-15H2
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2-(1H-Imidazol-1-yl)-6-trifluoromethylpyridine
Cas Number: 1215266-61-7Formula: C9H6F3N3Molecular weight: 213.2Synonyms: 1215266-61-7|2-(1H-Imidazol-1-yl)-6-(trifluoromethyl)pyridine|2-(1H-IMIDAZOL-1-YL)-6-TRIFLUOROMETHYL...SMILES: C1=CC(=NC(=C1)N2C=CN=C2)C(F)(F)FInChIKey: JPUQWWQTPRLRLB-UHFFFAOYSA-NInChI: InChI=1S/C9H6F3N3/c10-9(11,12)7-2-1-3-8(14-7)15-5-4-13-6-15/h1-6H
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3,3-Bis(bromomethyl)-1-(p-toluenesulfonyl)azetidine
Cas Number: 1041026-61-2Formula: C12H15Br2NO2SMolecular weight: 397.13Synonyms: 1041026-61-2|3,3-Bis(bromomethyl)-1-tosylazetidine|3,3-Bis(bromomethyl)-1-(p-toluenesulfonyl)azetidi...SMILES: CC1=CC=C(C=C1)S(=O)(=O)N2CC(C2)(CBr)CBrInChIKey: IOQDNRYTTAIWTH-UHFFFAOYSA-NInChI: InChI=1S/C12H15Br2NO2S/c1-10-2-4-11(5-3-10)18(16,17)15-8-12(6-13,7-14)9-15/h2-5H,6-9H2,1H3
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Methyl 2-amino-4-cyclopropylthiazole-5-carboxylate
Cas Number: 1065074-61-4Formula: C8H10N2O2SMolecular weight: 198.2Synonyms: METHYL 2-AMINO-4-CYCLOPROPYLTHIAZOLE-5-CARBOXYLATE|1065074-61-4|methyl 2-amino-4-cyclopropyl-1,3-thi...SMILES: COC(=O)C1=C(N=C(S1)N)C2CC2InChIKey: QRLSMSRWINQRJB-UHFFFAOYSA-NInChI: InChI=1S/C8H10N2O2S/c1-12-7(11)6-5(4-2-3-4)10-8(9)13-6/h4H,2-3H2,1H3,(H2,9,10)
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3-[(2-methoxyethoxy)methyl]phenylboronic acid
Cas Number: 1256358-61-8Formula: C10H15BO4Molecular weight: 210Synonyms: 1256358-61-8|(3-((2-Methoxyethoxy)methyl)phenyl)boronic acid|3-[(2-METHOXYETHOXY)METHYL]PHENYLBORONI...SMILES: B(C1=CC(=CC=C1)COCCOC)(O)OInChIKey: SDOBFXINMOTWOZ-UHFFFAOYSA-NInChI: InChI=1S/C10H15BO4/c1-14-5-6-15-8-9-3-2-4-10(7-9)11(12)13/h2-4,7,12-13H,5-6,8H2,1H3
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2-Chloro-4-(trifluoromethyl)thiazole-5-carboxylic acid
Cas Number: 72850-61-4Formula: C5HClF3NO2SMolecular weight: 231.58Synonyms: 72850-61-4|2-CHLORO-4-(TRIFLUOROMETHYL)THIAZOLE-5-CARBOXYLIC ACID|2-chloro-4-(trifluoromethyl)-1,3-t...SMILES: C1(=C(N=C(S1)Cl)C(F)(F)F)C(=O)OInChIKey: OGZUWSFEZCBGPH-UHFFFAOYSA-NInChI: InChI=1S/C5HClF3NO2S/c6-4-10-2(5(7,8)9)1(13-4)3(11)12/h(H,11,12)
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4-(2,4-Dichlorophenyl)-5-methylthiazol-2-amine
Cas Number: 188120-61-8Formula: C10H8Cl2N2SMolecular weight: 259.15Synonyms: 4-(2,4-dichlorophenyl)-5-methyl-1,3-thiazol-2-amine|188120-61-8|4-(2,4-Dichlorophenyl)-5-methylthiaz...SMILES: CC1=C(N=C(S1)N)C2=C(C=C(C=C2)Cl)ClInChIKey: SUELLSJOIIXFPP-UHFFFAOYSA-NInChI: InChI=1S/C10H8Cl2N2S/c1-5-9(14-10(13)15-5)7-3-2-6(11)4-8(7)12/h2-4H,1H3,(H2,13,14)
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3-(Methoxycarbonyl)-5-trifluoromethylphenylboronic acid, pinacol ester
Cas Number: 1150271-61-6Formula: C15H18BF3O4Molecular weight: 330.1Synonyms: Z3235022014 | 3-(Methoxycarbonyl)-5-trifluoromethylphenylboronic acid,pinacol ester | W17447 | DS-18...SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)C(F)(F)F)C(=O)OCInChIKey: UDZGGUNDDHBCGY-UHFFFAOYSA-NInChI: InChI=1S/C15H18BF3O4/c1-13(2)14(3,4)23-16(22-13)11-7-9(12(20)21-5)6-10(8-11)15(17,18)19/h6-8H,1-5H3
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trans-2-Ethoxyvinylboronic acid pinacol ester
Cas Number: 1201905-61-4Formula: C10H19BO3Molecular weight: 198.07Synonyms: 1201905-61-4|(E)-1-Ethoxyethene-2-boronic acid pinacol ester|(E)-2-(2-Ethoxyvinyl)-4,4,5,5-tetrameth...SMILES: B1(OC(C(O1)(C)C)(C)C)C=COCCInChIKey: MRAYNLYCQPAZJN-BQYQJAHWSA-NInChI: InChI=1S/C10H19BO3/c1-6-12-8-7-11-13-9(2,3)10(4,5)14-11/h7-8H,6H2,1-5H3/b8-7+
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2,5-Dichlorotoluene
Cas Number: 19398-61-9 EC Number: 243-032-2Formula: C7H6Cl2Molecular weight: 161.03Synonyms: 2,5-DICHLOROTOLUENE|19398-61-9|1,4-Dichloro-2-methylbenzene|Benzene, 1,4-dichloro-2-methyl-|Toluene,...SMILES: CC1=C(C=CC(=C1)Cl)ClInChIKey: KFAKZJUYBOYVKA-UHFFFAOYSA-NInChI: InChI=1S/C7H6Cl2/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3
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2-Bromodibenzothiophene
Cas Number: 22439-61-8Formula: C12H7BrSMolecular weight: 263.15Synonyms: 2-Bromodibenzothiophene|22439-61-8|2-Bromodibenzo[b,d]thiophene|2-bromo-dibenzothiophene|MFCD0008928...SMILES: C1=CC=C2C(=C1)C3=C(S2)C=CC(=C3)BrInChIKey: IJICRIUYZZESMW-UHFFFAOYSA-NInChI: InChI=1S/C12H7BrS/c13-8-5-6-12-10(7-8)9-3-1-2-4-11(9)14-12/h1-7H
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