[2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[2,5-bis(oxidanylidene)-3-phenylsulfanyl-pyrrolidin-1-yl]benzoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] 4-[2,5-bis(oxidanylidene)-3-phenylsulfanyl-pyrrolidin-1-yl]benzoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] 4-(2,5-dioxo-3-phenylsulfanyl-pyrrolidin-1-yl)benzoate CAS Name: 4-[2,5-dioxo-3-(phenylthio)-1-pyrrolidinyl]benzoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] 4-(2,5-dioxo-3-phenylsulfanylpyrrolidin-1-yl)benzoate Traditional Name: 4-[2,5-diketo-3-(phenylthio)pyrrolidino]benzoic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C25H18BrNO5S MolecularWeight: 524.38312

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)SC4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br)SC4=CC=CC=C4

InChI

InChI=1S/C25H18BrNO5S/c26-18-10-6-16(7-11-18)21(28)15-32-25(31)17-8-12-19(13-9-17)27-23(29)14-22(24(27)30)33-20-4-2-1-3-5-20/h1-13,22H,14-15H2