methyl 3-[(3-methylphenyl)carbamothioylamino]benzoate

Systemtic Name: methyl 3-[(3-methylphenyl)carbamothioylamino]benzoate Openeye Name: methyl 3-(m-tolylcarbamothioylamino)benzoate CAS Name: 3-[[(3-methylanilino)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-methylphenyl)carbamothioylamino]benzoate Traditional Name: 3-(m-tolylthiocarbamoylamino)benzoic acid methyl ester Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NC2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H16N2O2S/c1-11-5-3-7-13(9-11)17-16(21)18-14-8-4-6-12(10-14)15(19)20-2/h3-10H,1-2H3,(H2,17,18,21)