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

Systemtic Name: [2-(2,4-dichlorophenyl)-2-oxidanylidene-ethyl] 4-[3-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: [2-(2,4-dichlorophenyl)-2-oxo-ethyl] 4-[3-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-2,5-dioxo-1-pyrrolidinyl]benzoic acid [2-(2,4-dichlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dichlorophenyl)-2-oxoethyl] 4-[3-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-[(3-ethyl-4-keto-quinazolin-2-yl)thio]-2,5-diketo-pyrrolidino]benzoic acid [2-(2,4-dichlorophenyl)-2-keto-ethyl] ester Formula: C29H21Cl2N3O6S MolecularWeight: 610.46454

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC3CC(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC(=O)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SC3CC(=O)N(C3=O)C4=CC=C(C=C4)C(=O)OCC(=O)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C29H21Cl2N3O6S/c1-2-33-26(37)20-5-3-4-6-22(20)32-29(33)41-24-14-25(36)34(27(24)38)18-10-7-16(8-11-18)28(39)40-15-23(35)19-12-9-17(30)13-21(19)31/h3-13,24H,2,14-15H2,1H3