[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(3,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(3,4-dimethylphenyl)sulfanylethanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] 2-(3,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(3,4-dimethylphenyl)thio]acetic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] 2-(3,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(3,4-dimethylphenyl)thio]acetic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C14H18N2O4S MolecularWeight: 310.36872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O4S/c1-9-4-5-11(6-10(9)2)21-8-13(18)20-7-12(17)16-14(19)15-3/h4-6H,7-8H2,1-3H3,(H2,15,16,17,19)