(1-azanyl-1-oxidanylidene-propan-2-yl) 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 2-(2-methylphenyl)sulfanylethanoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OC(C)C(=O)N

InChI

InChI=1S/C12H15NO3S/c1-8-5-3-4-6-10(8)17-7-11(14)16-9(2)12(13)15/h3-6,9H,7H2,1-2H3,(H2,13,15)