methyl 2-[methyl-[(4-methylphenyl)carbonylcarbamothioyl]amino]ethanoate

Systemtic Name: methyl 2-[methyl-[(4-methylphenyl)carbonylcarbamothioyl]amino]ethanoate Openeye Name: methyl 2-[methyl-[(4-methylbenzoyl)carbamothioyl]amino]acetate CAS Name: 2-[methyl-[[[(4-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[methyl-[(4-methylbenzoyl)carbamothioyl]amino]acetate Traditional Name: 2-[methyl(p-toluoylthiocarbamoyl)amino]acetic acid methyl ester Formula: C13H16N2O3S MolecularWeight: 280.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)N(C)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)N(C)CC(=O)OC

InChI

InChI=1S/C13H16N2O3S/c1-9-4-6-10(7-5-9)12(17)14-13(19)15(2)8-11(16)18-3/h4-7H,8H2,1-3H3,(H,14,17,19)