methyl 2-[[3-[ethanethioyl(ethanoyl)amino]phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[3-[ethanethioyl(ethanoyl)amino]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[3-[acetyl(ethanethioyl)amino]benzoyl]amino]acetate CAS Name: 2-[[[3-[acetyl(1-sulfanylideneethyl)amino]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[3-[acetyl(ethanethioyl)amino]benzoyl]amino]acetate Traditional Name: 2-[[3-[acetyl(thioacetyl)amino]benzoyl]amino]acetic acid methyl ester Formula: C14H16N2O4S MolecularWeight: 308.35284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC(=C1)C(=O)NCC(=O)OC)C(=S)C

Isomeric SMILES

CC(=O)N(C1=CC=CC(=C1)C(=O)NCC(=O)OC)C(=S)C

InChI

InChI=1S/C14H16N2O4S/c1-9(17)16(10(2)21)12-6-4-5-11(7-12)14(19)15-8-13(18)20-3/h4-7H,8H2,1-3H3,(H,15,19)