ethyl 2-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-chloro-3-(1-piperidylsulfonyl)benzoyl]amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]-4-(3,4-dimethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-chloro-3-piperidin-1-ylsulfonylbenzoyl)amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(4-chloro-3-piperidinosulfonyl-benzoyl)amino]-4-(3,4-dimethoxyphenyl)thiophene-3-carboxylic acid ethyl ester Formula: C27H29ClN2O7S2 MolecularWeight: 593.11136

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=C(C=C2)OC)OC)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C27H29ClN2O7S2/c1-4-37-27(32)24-19(17-9-11-21(35-2)22(14-17)36-3)16-38-26(24)29-25(31)18-8-10-20(28)23(15-18)39(33,34)30-12-6-5-7-13-30/h8-11,14-16H,4-7,12-13H2,1-3H3,(H,29,31)