ethyl 3-[(4-methylphenyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 3-[(4-methylphenyl)carbamothioylamino]benzoate Openeye Name: ethyl 3-(p-tolylcarbamothioylamino)benzoate CAS Name: 3-[[(4-methylanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-methylphenyl)carbamothioylamino]benzoate Traditional Name: 3-(p-tolylthiocarbamoylamino)benzoic acid ethyl ester Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=S)NC2=CC=C(C=C2)C

InChI

InChI=1S/C17H18N2O2S/c1-3-21-16(20)13-5-4-6-15(11-13)19-17(22)18-14-9-7-12(2)8-10-14/h4-11H,3H2,1-2H3,(H2,18,19,22)