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Search results for: '1257379-83-1'
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Iron(III) 1,3,5-benzenetricarboxylate hydrate
Cas Number: 1257379-83-1Formula: C18H8Fe3O16Molecular weight: 650.81Synonyms: 1257379-83-1 | Diaquabis[mu-[1,3,5-benzenetricarboxylato(3-)-kappaO1:kappaO'1]]hydroxy-mu3-oxotriiro...SMILES: C1=C(C=C(C=C1C(=O)[O-])C(=O)[O-])C(=O)[O-].C1=C(C=C(C=C1C(=O)[O-])C(=O)[O-])C(=O)[O-].O.O.[OH-].[O-2].[Fe+3].[Fe+3].[Fe+3]InChIKey: SMLBFMJBZCXCLA-UHFFFAOYSA-GInChI: InChI=1S/2C9H6O6.3Fe.3H2O.O/c2*10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15;;;;;;;/h2*1-3H,(H,10,11)(H,12,13)(H,14,15);;;;3*1H2;/q;;3*+3;;;;-2/p-7
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Flurbiprofen Axetil (mixture of diastereoisomers)
Cas Number: 91503-79-6Formula: C19H19FO4Molecular weight: 330.36Synonyms: flurbiprofen axetil|91503-79-6|Ropion|1-Acetoxyethyl 2-(2-fluoro-[1,1'-biphenyl]-4-yl)propanoate|Lip...SMILES: CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)OC(C)OC(=O)CInChIKey: ALIVXCSEERJYHU-UHFFFAOYSA-NInChI: InChI=1S/C19H19FO4/c1-12(19(22)24-14(3)23-13(2)21)16-9-10-17(18(20)11-16)15-7-5-4-6-8-15/h4-12,14H,1-3H3
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3-azabicyclo[3.1.1]heptan-1-amine;dihydrochloride
Cas Number: 220593-83-9Synonyms: SCHEMBL7930218 | F89833 | 3-AZABICYCLO[3.1.1]HEPTAN-1-AMINE DIHYDROCHLORIDE | 220593-83-9SMILES: C1C2CC1(CNC2)N.Cl.ClInChIKey: PRUAOXGNFKCGNL-UHFFFAOYSA-NInChI: InChI=1S/C6H12N2.2ClH/c7-6-1-5(2-6)3-8-4-6;;/h5,8H,1-4,7H2;2*1H
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methyl 3-(iodomethyl)cyclobutanecarboxylate
Cas Number: 2411638-83-8Formula: C7H11O2IMolecular weight: 254.06Synonyms: methyl 3-(iodomethyl)cyclobutanecarboxylate | F78176 | Methyl 3-(iodomethyl)cyclobutane-1-carboxylat...SMILES: COC(=O)C1CC(C1)CIInChIKey: BUVPIEMUNYQJAO-UHFFFAOYSA-NInChI: InChI=1S/C7H11IO2/c1-10-7(9)6-2-5(3-6)4-8/h5-6H,2-4H2,1H3
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Lisinopril Dihydrate, Angiotensin-converting enzyme inhibitor
Cas Number: 83915-83-7Formula: C21H31N3O5· 2H2OMolecular weight: 405.49(as Anhydrous)Synonyms: Lisinopril dihydrate|83915-83-7|Renacor|Ranolip|Lisinopril hydrate|Lisinopril (dihydrate)|MK-521|CHE...SMILES: C1CC(N(C1)C(=O)C(CCCCN)NC(CCC2=CC=CC=C2)C(=O)O)C(=O)O.O.OInChIKey: CZRQXSDBMCMPNJ-ZUIPZQNBSA-NInChI: InChI=1S/C21H31N3O5.2H2O/c22-13-5-4-9-16(19(25)24-14-6-10-18(24)21(28)29)23-17(20(26)27)12-11-15-7-2-1-3-8-15;;/h1-3,7-8,16-18,23H,4-6,9-14,22H2,(H,26,27)(H,28,29);2*1H2/t16-,17-,18-;;/m0../s1
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N,N-bis[(2,4-dimethoxyphenyl)methyl]-1-phenyl-methanesulfonamide
Cas Number: 803727-83-5Formula: C25H29NO6SMolecular weight: 471.56Synonyms: SCHEMBL22089765 | F89141 | N,N-BIS[(2,4-DIMETHOXYPHENYL)METHYL]-1-PHENYL-METHANESULFONAMIDE | 803727...SMILES: COC1=CC(=C(C=C1)CN(CC2=C(C=C(C=C2)OC)OC)S(=O)(=O)CC3=CC=CC=C3)OCInChIKey: YKSOMXIRKBWIBC-UHFFFAOYSA-NInChI: InChI=1S/C25H29NO6S/c1-29-22-12-10-20(24(14-22)31-3)16-26(33(27,28)18-19-8-6-5-7-9-19)17-21-11-13-23(30-2)15-25(21)32-4/h5-15H,16-18H2,1-4H3
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4-bromo-N,N-dimethyl-3-(trifluoromethyl)pyrazole-1-sulfonamide
Cas Number: 2387598-83-4Formula: C6H7N3O2F3SBrMolecular weight: 322.1Synonyms: 4-bromo-N,N-dimethyl-3-(trifluoromethyl)pyrazole-1-sulfonamide | 2387598-83-4 | MFCD32263286 | P1983...SMILES: CN(C)S(=O)(=O)N1C=C(C(=N1)C(F)(F)F)BrInChIKey: ZMNGLLMNFXYBJQ-UHFFFAOYSA-NInChI: InChI=1S/C6H7BrF3N3O2S/c1-12(2)16(14,15)13-3-4(7)5(11-13)6(8,9)10/h3H,1-2H3
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1-(ChloroMethyl)-1,1,3,3,3-pentaMethyldisiloxane
Cas Number: 17201-83-1Formula: C6H17ClOSi2Molecular weight: 196.82Synonyms: 17201-83-1|CHLOROMETHYLPENTAMETHYLDISILOXANE|1-(chloromethyl)-1,1,3,3,3-pentamethyldisiloxane|chloro...SMILES: C[Si](C)(C)O[Si](C)(C)CClInChIKey: OBSWSTDGLWZVEI-UHFFFAOYSA-NInChI: InChI=1S/C6H17ClOSi2/c1-9(2,3)8-10(4,5)6-7/h6H2,1-5H3
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(1-(Methoxymethyl)cyclopropyl)methanamine
Cas Number: 883311-83-9 EC Number: 850-298-9Formula: C6H13NOMolecular weight: 115.17Synonyms: 883311-83-9|(1-(Methoxymethyl)cyclopropyl)methanamine|[1-(methoxymethyl)cyclopropyl]methanamine|([1-...SMILES: COCC1(CC1)CNInChIKey: GLLBCNNWOPIIOD-UHFFFAOYSA-NInChI: InChI=1S/C6H13NO/c1-8-5-6(4-7)2-3-6/h2-5,7H2,1H3
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bicyclo[3.2.1]octane-1-carboxylic acid
Cas Number: 2534-83-0Formula: C9H14O2Molecular weight: 154.21Synonyms: Bicyclo[3.2.1]octane-1-carboxylic acid | 2534-83-0 | SCHEMBL11015180 | Bicyclo[3.2.1]octane-1-carbox...SMILES: C1CC2CCC(C1)(C2)C(=O)OInChIKey: HJDYARCZSGKTIG-UHFFFAOYSA-NInChI: InChI=1S/C9H14O2/c10-8(11)9-4-1-2-7(6-9)3-5-9/h7H,1-6H2,(H,10,11)
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(1-fluorocyclopentyl)methanamine
Cas Number: 1463052-83-6Formula: C6H12FNMolecular weight: 117.17Synonyms: (1-fluorocyclopentyl)methanamine | 1463052-83-6 | 1-Fluorocyclopentane-1-methaneamine | AMY34317 | M...SMILES: C1CCC(C1)(CN)FInChIKey: HHQVFFOIAFPUOK-UHFFFAOYSA-NInChI: InChI=1S/C6H12FN/c7-6(5-8)3-1-2-4-6/h1-5,8H2
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cyclobutylmethanamine
Cas Number: 4415-83-2Formula: C5H11NMolecular weight: 85.15Synonyms: cyclobutylmethanamine|4415-83-2|Cyclobutanemethanamine|CYCLOBUTYLMETHYLAMINE|1-Cyclobutylmethylamine...SMILES: C1CC(C1)CNInChIKey: LQNHRNOPWKZUSN-UHFFFAOYSA-NInChI: InChI=1S/C5H11N/c6-4-5-2-1-3-5/h5H,1-4,6H2
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1-Heptyl isothiocyanate
Formula: C8H15NSMolecular weight: 157.28Synonyms: Heptyl isothiocyanate|4426-83-9|1-Isothiocyanatoheptane|Heptane, 1-isothiocyanato-|Heptylisothiocyan...SMILES: CCCCCCCN=C=SInChIKey: LIPUQNPCPLDDBO-UHFFFAOYSA-NInChI: InChI=1S/C8H15NS/c1-2-3-4-5-6-7-9-8-10/h2-7H2,1H3
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1-BUTYL-4-METHYLPIPERIDINE
Cas Number: 103199-83-3Formula: C10H21NMolecular weight: 155.286Synonyms: 1-butyl-4-methylpiperidine|1-(N-BUTYL)-4-METHYLPIPERIDINE|103199-83-3|Piperidine, 1-butyl-4-methyl|S...SMILES: CCCCN1CCC(CC1)CInChIKey: AXMCYIWXDKWDCL-UHFFFAOYSA-NInChI: InChI=1S/C10H21N/c1-3-4-7-11-8-5-10(2)6-9-11/h10H,3-9H2,1-2H3
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MK6-83, Activator of TRPML1;Activator of TRPML3
Cas Number: 1062271-24-2Formula: C16H20N2O2S2Molecular weight: 336.47Synonyms: AKOS025147398 | MK683 | MK6-83 | 5-methyl-N-(2-piperidin-1-ylphenyl)thiophene-2-sulfonamide | 2-Thio...SMILES: CC1=CC=C(S1)S(=O)(=O)NC2=CC=CC=C2N3CCCCC3InChIKey: IRGYSXZCDAWOOC-UHFFFAOYSA-NInChI: InChI=1S/C16H20N2O2S2/c1-13-9-10-16(21-13)22(19,20)17-14-7-3-4-8-15(14)18-11-5-2-6-12-18/h3-4,7-10,17H,2,5-6,11-12H2,1H3
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1-(3-bromophenyl)cyclopropane-1-carbonitrile
Cas Number: 124276-83-1Formula: C10H8BrNMolecular weight: 222.081Synonyms: 1-(3-Bromophenyl)cyclopropanecarbonitrile|124276-83-1|1-(3-BROMOPHENYL)CYCLOPROPANE-1-CARBONITRILE|C...SMILES: C1CC1(C#N)C2=CC(=CC=C2)BrInChIKey: VHNBUFCWKWBTIZ-UHFFFAOYSA-NInChI: InChI=1S/C10H8BrN/c11-9-3-1-2-8(6-9)10(7-12)4-5-10/h1-3,6H,4-5H2
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Trigonelline
Cas Number: 535-83-1Formula: C7H7NO2Molecular weight: 137.14Synonyms: Trigonelline|535-83-1|Trigenolline|N-Methylnicotinate|Caffearine|Gynesine|Coffearine|Betain nicotina...SMILES: C[N+]1=CC=CC(=C1)C(=O)[O-]InChIKey: WWNNZCOKKKDOPX-UHFFFAOYSA-NInChI: InChI=1S/C7H7NO2/c1-8-4-2-3-6(5-8)7(9)10/h2-5H,1H3
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2,3-Dichlorothiobenzamide
Cas Number: 84863-83-2Formula: C7H5Cl2NSMolecular weight: 206.09Synonyms: 2,3-Dichlorothiobenzamide|84863-83-2|2,3-dichlorobenzothioamide|2,3-dichlorobenzenecarbothioamide|2,...SMILES: C1=CC(=C(C(=C1)Cl)Cl)C(=S)NInChIKey: PRRMJTDPKZBCCQ-UHFFFAOYSA-NInChI: InChI=1S/C7H5Cl2NS/c8-5-3-1-2-4(6(5)9)7(10)11/h1-3H,(H2,10,11)
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3,5-Difluorophenyl isocyanate
Cas Number: 83594-83-6Formula: F2C6H3NCOMolecular weight: 155.1Synonyms: 83594-83-6|3,5-Difluorophenyl isocyanate|3,5-Difluorophenylisocyanate|1,3-difluoro-5-isocyanatobenze...SMILES: C1=C(C=C(C=C1F)F)N=C=OInChIKey: WUCCJYOIAJTFFQ-UHFFFAOYSA-NInChI: InChI=1S/C7H3F2NO/c8-5-1-6(9)3-7(2-5)10-4-11/h1-3H
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Ethyl 1-bromocyclopropanecarboxylate
Cas Number: 89544-83-2Formula: C6H9BrO2Molecular weight: 193.04Synonyms: Ethyl 1-bromocyclopropanecarboxylate|89544-83-2|ETHYL 1-BROMOCYCLOPROPANE-1-CARBOXYLATE|MFCD01314227...SMILES: CCOC(=O)C1(CC1)BrInChIKey: OZANNKKBYBYGCQ-UHFFFAOYSA-NInChI: InChI=1S/C6H9BrO2/c1-2-9-5(8)6(7)3-4-6/h2-4H2,1H3
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Rabusertib (LY2603618), Serine/threonine-protein kinase Chk1 inhibitor
Cas Number: 911222-45-2(DMSO)Formula: C18H22BrN5O3Molecular weight: 436.3Synonyms: IC-83 | (S)-1-(5-bromo-4-methyl-2-(morpholin-2-ylmethoxy)phenyl)-3-(5-methylpyrazin-2-yl)ureaSMILES: CC1=NC=C(NC(=O)NC2=C(OCC3CNCCO3)C=C(C)C(=C2)Br)N=C1
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tert-butyl (5R)-1,7-diazaspiro[4.4]nonane-1-carboxylate
Cas Number: 2165623-83-4Formula: C12H22N2O2Molecular weight: 226.31Synonyms: 2165623-83-4 | tert-butyl (5R)-1,7-diazaspiro[4.4]nonane-1-carboxylate | F78297 | TERT-BUTYL (R)-1,7...SMILES: CC(C)(C)OC(=O)N1CCCC12CCNC2InChIKey: LZBANXJWOBNBLH-GFCCVEGCSA-NInChI: InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-8-4-5-12(14)6-7-13-9-12/h13H,4-9H2,1-3H3/t12-/m1/s1
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1H-Pyrrolo[2,3-b]pyridine-4-carboxamide
Cas Number: 1086390-83-1Formula: C8H7N3OMolecular weight: 161.16Synonyms: BDBM50455565 | SCHEMBL2606616 | AKOS006309973 | MFCD11046289 | 1H-Pyrrolo[2,3-b]pyridine-4-carboxami...SMILES: C1=CNC2=NC=CC(=C21)C(=O)NInChIKey: JLNLMSPUHPBAFQ-UHFFFAOYSA-NInChI: InChI=1S/C8H7N3O/c9-7(12)5-1-3-10-8-6(5)2-4-11-8/h1-4H,(H2,9,12)(H,10,11)
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1-(4-Methoxybenzoyl)-4-piperidinecarboxylic acid
Cas Number: 510739-83-0Formula: C14H17NO4Molecular weight: 263.29Synonyms: 510739-83-0|1-(4-methoxybenzoyl)piperidine-4-carboxylic acid|1-(4-methoxybenzoyl)-4-piperidinecarbox...SMILES: COC1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)OInChIKey: ZMEVUKYYWCUUJF-UHFFFAOYSA-NInChI: InChI=1S/C14H17NO4/c1-19-12-4-2-10(3-5-12)13(16)15-8-6-11(7-9-15)14(17)18/h2-5,11H,6-9H2,1H3,(H,17,18)
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