[2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: [2-[(2-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: [2-(2-chloro-4-methyl-anilino)-2-oxo-ethyl] 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid [2-(2-chloro-4-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-chloro-4-methylanilino)-2-oxoethyl] 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid [2-(2-chloro-4-methyl-anilino)-2-keto-ethyl] ester Formula: C23H17ClN2O3S MolecularWeight: 436.91068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)Cl

InChI

InChI=1S/C23H17ClN2O3S/c1-15-10-11-19(18(24)12-15)26-22(27)14-29-23(28)17-7-3-5-9-21(17)30-20-8-4-2-6-16(20)13-25/h2-12H,14H2,1H3,(H,26,27)