[(1S)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-methylsulfanylbenzoate

Systemtic Name: [(1S)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl] 2-methylsulfanylbenzoate Openeye Name: [(1S)-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-1-phenyl-ethyl] 2-methylsulfanylbenzoate CAS Name: 2-(methylthio)benzoic acid [(1S)-2-[(5-methyl-3-isoxazolyl)amino]-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxo-1-phenylethyl] 2-methylsulfanylbenzoate Traditional Name: 2-(methylthio)benzoic acid [(1S)-2-keto-2-[(5-methylisoxazol-3-yl)amino]-1-phenyl-ethyl] ester Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=CC=C3SC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3=CC=CC=C3SC

InChI

InChI=1S/C20H18N2O4S/c1-13-12-17(22-26-13)21-19(23)18(14-8-4-3-5-9-14)25-20(24)15-10-6-7-11-16(15)27-2/h3-12,18H,1-2H3,(H,21,22,23)/t18-/m0/s1