ethyl 4,5-dimethyl-2-[3-(4-methylphenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[3-(4-methylphenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]thiophene-3-carboxylate Openeye Name: ethyl 2-[2,5-dioxo-3-(p-tolylsulfanyl)pyrrolidin-1-yl]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[3-[(4-methylphenyl)thio]-2,5-dioxo-1-pyrrolidinyl]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[3-(4-methylphenyl)sulfanyl-2,5-dioxopyrrolidin-1-yl]thiophene-3-carboxylate Traditional Name: 2-[2,5-diketo-3-(p-tolylthio)pyrrolidino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C20H21NO4S2 MolecularWeight: 403.51504

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)N2C(=O)CC(C2=O)SC3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)N2C(=O)CC(C2=O)SC3=CC=C(C=C3)C

InChI

InChI=1S/C20H21NO4S2/c1-5-25-20(24)17-12(3)13(4)26-19(17)21-16(22)10-15(18(21)23)27-14-8-6-11(2)7-9-14/h6-9,15H,5,10H2,1-4H3