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

Systemtic Name: phenacyl 4-[3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: phenacyl 4-[3-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[(3-methyl-4-oxo-2-quinazolinyl)thio]-2,5-dioxo-1-pyrrolidinyl]benzoic acid phenacyl ester IUPAC Name: phenacyl 4-[3-(3-methyl-4-oxoquinazolin-2-yl)sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[2,5-diketo-3-[(4-keto-3-methyl-quinazolin-2-yl)thio]pyrrolidino]benzoic acid phenacyl ester Formula: C28H21N3O6S MolecularWeight: 527.54784

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C1SC3CC(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC(=O)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C1SC3CC(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H21N3O6S/c1-30-25(34)20-9-5-6-10-21(20)29-28(30)38-23-15-24(33)31(26(23)35)19-13-11-18(12-14-19)27(36)37-16-22(32)17-7-3-2-4-8-17/h2-14,23H,15-16H2,1H3