[2-(2-chlorophenyl)-2-oxidanylidene-ethyl] 4-[3-[6-(2-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: [2-(2-chlorophenyl)-2-oxidanylidene-ethyl] 4-[3-[6-(2-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanyl-2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: [2-(2-chlorophenyl)-2-oxo-ethyl] 4-[3-[[6-(2-chlorophenyl)-3-cyano-2-pyridyl]sulfanyl]-2,5-dioxo-pyrrolidin-1-yl]benzoate CAS Name: 4-[3-[[6-(2-chlorophenyl)-3-cyano-2-pyridinyl]thio]-2,5-dioxo-1-pyrrolidinyl]benzoic acid [2-(2-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(2-chlorophenyl)-2-oxoethyl] 4-[3-[6-(2-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl-2,5-dioxopyrrolidin-1-yl]benzoate Traditional Name: 4-[3-[[6-(2-chlorophenyl)-3-cyano-2-pyridyl]thio]-2,5-diketo-pyrrolidino]benzoic acid [2-(2-chlorophenyl)-2-keto-ethyl] ester Formula: C31H19Cl2N3O5S MolecularWeight: 616.47066

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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=CC=C3Cl)SC4=C(C=CC(=N4)C5=CC=CC=C5Cl)C#N

Isomeric SMILES

C1C(C(=O)N(C1=O)C2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=CC=C3Cl)SC4=C(C=CC(=N4)C5=CC=CC=C5Cl)C#N

InChI

InChI=1S/C31H19Cl2N3O5S/c32-23-7-3-1-5-21(23)25-14-11-19(16-34)29(35-25)42-27-15-28(38)36(30(27)39)20-12-9-18(10-13-20)31(40)41-17-26(37)22-6-2-4-8-24(22)33/h1-14,27H,15,17H2