[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenyl-2-phenylsulfanyl-ethanoate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenyl-2-phenylsulfanyl-ethanoate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] (2R)-2-phenyl-2-phenylsulfanyl-acetate CAS Name: (2R)-2-phenyl-2-(phenylthio)acetic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] (2R)-2-phenyl-2-phenylsulfanylacetate Traditional Name: (2R)-2-phenyl-2-(phenylthio)acetic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)OCC(=O)NC2=CC=CC(=C2)C#N)SC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)[C@H](C(=O)OCC(=O)NC2=CC=CC(=C2)C#N)SC3=CC=CC=C3

InChI

InChI=1S/C23H18N2O3S/c24-15-17-8-7-11-19(14-17)25-21(26)16-28-23(27)22(18-9-3-1-4-10-18)29-20-12-5-2-6-13-20/h1-14,22H,16H2,(H,25,26)/t22-/m1/s1