[2-[[2-(cyanomethylsulfanyl)phenyl]amino]-2-oxidanylidene-ethyl] 2,2-diphenylethanoate

Systemtic Name: [2-[[2-(cyanomethylsulfanyl)phenyl]amino]-2-oxidanylidene-ethyl] 2,2-diphenylethanoate Openeye Name: [2-[2-(cyanomethylsulfanyl)anilino]-2-oxo-ethyl] 2,2-diphenylacetate CAS Name: 2,2-diphenylacetic acid [2-[2-(cyanomethylthio)anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-(cyanomethylsulfanyl)anilino]-2-oxoethyl] 2,2-diphenylacetate Traditional Name: 2,2-diphenylacetic acid [2-[2-(cyanomethylthio)anilino]-2-keto-ethyl] ester Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OCC(=O)NC3=CC=CC=C3SCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)C(=O)OCC(=O)NC3=CC=CC=C3SCC#N

InChI

InChI=1S/C24H20N2O3S/c25-15-16-30-21-14-8-7-13-20(21)26-22(27)17-29-24(28)23(18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-14,23H,16-17H2,(H,26,27)