[2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 3,4-dimethylbenzoate

Systemtic Name: [2-oxidanylidene-2-[(2-phenylsulfanylphenyl)amino]ethyl] 3,4-dimethylbenzoate Openeye Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid [2-oxo-2-[2-(phenylthio)anilino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylanilino)ethyl] 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid [2-keto-2-[2-(phenylthio)anilino]ethyl] ester Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NC2=CC=CC=C2SC3=CC=CC=C3)C

InChI

InChI=1S/C23H21NO3S/c1-16-12-13-18(14-17(16)2)23(26)27-15-22(25)24-20-10-6-7-11-21(20)28-19-8-4-3-5-9-19/h3-14H,15H2,1-2H3,(H,24,25)