(2-azanyl-2-oxidanylidene-ethyl) 2-(3,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: (2-azanyl-2-oxidanylidene-ethyl) 2-(3,4-dimethylphenyl)sulfanylethanoate Openeye Name: (2-amino-2-oxo-ethyl) 2-(3,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(3,4-dimethylphenyl)thio]acetic acid (2-amino-2-oxoethyl) ester IUPAC Name: (2-amino-2-oxoethyl) 2-(3,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(3,4-dimethylphenyl)thio]acetic acid (2-amino-2-keto-ethyl) ester Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)OCC(=O)N)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)OCC(=O)N)C

InChI

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