ethyl 4-phenyl-2-[[1-(phenylsulfonyl)piperidin-2-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-phenyl-2-[[1-(phenylsulfonyl)piperidin-2-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[1-(benzenesulfonyl)piperidine-2-carbonyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[1-(benzenesulfonyl)-2-piperidinyl]-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1-(benzenesulfonyl)piperidine-2-carbonyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(1-besylpipecoloyl)amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C25H26N2O5S2 MolecularWeight: 498.61434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C3CCCCN3S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H26N2O5S2/c1-2-32-25(29)22-20(18-11-5-3-6-12-18)17-33-24(22)26-23(28)21-15-9-10-16-27(21)34(30,31)19-13-7-4-8-14-19/h3-8,11-14,17,21H,2,9-10,15-16H2,1H3,(H,26,28)