methyl 5-phenyl-3-[[1-(phenylsulfonyl)piperidin-3-yl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-phenyl-3-[[1-(phenylsulfonyl)piperidin-3-yl]carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[1-(benzenesulfonyl)piperidine-3-carbonyl]amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[1-(benzenesulfonyl)-3-piperidinyl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-(benzenesulfonyl)piperidine-3-carbonyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[(1-besylnipecotoyl)amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C24H24N2O5S2 MolecularWeight: 484.58776

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C24H24N2O5S2/c1-31-24(28)22-20(15-21(32-22)17-9-4-2-5-10-17)25-23(27)18-11-8-14-26(16-18)33(29,30)19-12-6-3-7-13-19/h2-7,9-10,12-13,15,18H,8,11,14,16H2,1H3,(H,25,27)