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

Systemtic Name: phenacyl 4-[3-(4-methylphenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: phenacyl 4-[2,5-dioxo-3-(p-tolylsulfanyl)pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[(4-methylphenyl)thio]-2,5-dioxo-1-pyrrolidinyl]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[3-(4-methylphenyl)sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[2,5-diketo-3-(p-tolylthio)pyrrolidino]benzoic acid phenacyl ester Formula: C26H21NO5S MolecularWeight: 459.51364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)OCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H21NO5S/c1-17-7-13-21(14-8-17)33-23-15-24(29)27(25(23)30)20-11-9-19(10-12-20)26(31)32-16-22(28)18-5-3-2-4-6-18/h2-14,23H,15-16H2,1H3