[(2R)-1-[(2-methylsulfanylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-acetamidobenzoate

Systemtic Name: [(2R)-1-[(2-methylsulfanylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-acetamidobenzoate Openeye Name: [(1R)-1-methyl-2-(2-methylsulfanylanilino)-2-oxo-ethyl] 3-acetamidobenzoate CAS Name: 3-acetamidobenzoic acid [(2R)-1-[2-(methylthio)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methylsulfanylanilino)-1-oxopropan-2-yl] 3-acetamidobenzoate Traditional Name: 3-acetamidobenzoic acid [(1R)-2-keto-1-methyl-2-[2-(methylthio)anilino]ethyl] ester Formula: C19H20N2O4S MolecularWeight: 372.4381

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1SC)OC(=O)C2=CC(=CC=C2)NC(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1SC)OC(=O)C2=CC(=CC=C2)NC(=O)C

InChI

InChI=1S/C19H20N2O4S/c1-12(18(23)21-16-9-4-5-10-17(16)26-3)25-19(24)14-7-6-8-15(11-14)20-13(2)22/h4-12H,1-3H3,(H,20,22)(H,21,23)/t12-/m1/s1