ethyl 4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]benzoate

Systemtic Name: ethyl 4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]benzoate Openeye Name: ethyl 4-[[2-(o-tolyl)acetyl]carbamothioylamino]benzoate CAS Name: 4-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(2-methylphenyl)acetyl]carbamothioylamino]benzoate Traditional Name: 4-[[2-(o-tolyl)acetyl]thiocarbamoylamino]benzoic acid ethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2C

InChI

InChI=1S/C19H20N2O3S/c1-3-24-18(23)14-8-10-16(11-9-14)20-19(25)21-17(22)12-15-7-5-4-6-13(15)2/h4-11H,3,12H2,1-2H3,(H2,20,21,22,25)