methyl 3-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]-5-phenyl-thiophene-2-carboxylate

Systemtic Name: methyl 3-[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]-5-phenyl-thiophene-2-carboxylate Openeye Name: methyl 3-[(4-indolin-1-ylsulfonylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylate CAS Name: 3-[[[4-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]amino]-5-phenyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[4-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]amino]-5-phenylthiophene-2-carboxylate Traditional Name: 3-[(4-indolin-1-ylsulfonylbenzoyl)amino]-5-phenyl-thiophene-2-carboxylic acid methyl ester Formula: C27H22N2O5S2 MolecularWeight: 518.60398

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C54

Isomeric SMILES

COC(=O)C1=C(C=C(S1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCC5=CC=CC=C54

InChI

InChI=1S/C27H22N2O5S2/c1-34-27(31)25-22(17-24(35-25)19-8-3-2-4-9-19)28-26(30)20-11-13-21(14-12-20)36(32,33)29-16-15-18-7-5-6-10-23(18)29/h2-14,17H,15-16H2,1H3,(H,28,30)