methyl 4-[3-(4-acetamidophenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: methyl 4-[3-(4-acetamidophenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: methyl 4-[3-(4-acetamidophenyl)sulfanyl-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[(4-acetamidophenyl)thio]-2,5-dioxo-1-pyrrolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-(4-acetamidophenyl)sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-[(4-acetamidophenyl)thio]-2,5-diketo-pyrrolidino]benzoic acid methyl ester Formula: C20H18N2O5S MolecularWeight: 398.43232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C20H18N2O5S/c1-12(23)21-14-5-9-16(10-6-14)28-17-11-18(24)22(19(17)25)15-7-3-13(4-8-15)20(26)27-2/h3-10,17H,11H2,1-2H3,(H,21,23)