methyl 2-[methyl-[(phenylmethyl)carbamothioyl]amino]benzoate

Systemtic Name: methyl 2-[methyl-[(phenylmethyl)carbamothioyl]amino]benzoate Openeye Name: methyl 2-[benzylcarbamothioyl(methyl)amino]benzoate CAS Name: 2-[methyl-[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[benzylcarbamothioyl(methyl)amino]benzoate Traditional Name: 2-[benzylthiocarbamoyl(methyl)amino]benzoic acid methyl ester Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)OC)C(=S)NCC2=CC=CC=C2

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)OC)C(=S)NCC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O2S/c1-19(15-11-7-6-10-14(15)16(20)21-2)17(22)18-12-13-8-4-3-5-9-13/h3-11H,12H2,1-2H3,(H,18,22)