3,4-dimethyl-N-[(phenylmethyl)carbamothioyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[(phenylmethyl)carbamothioyl]benzamide Openeye Name: N-(benzylcarbamothioyl)-3,4-dimethyl-benzamide CAS Name: 3,4-dimethyl-N-[[(phenylmethyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-(benzylcarbamothioyl)-3,4-dimethylbenzamide Traditional Name: N-(benzylthiocarbamoyl)-3,4-dimethyl-benzamide Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NCC2=CC=CC=C2)C

InChI

InChI=1S/C17H18N2OS/c1-12-8-9-15(10-13(12)2)16(20)19-17(21)18-11-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H2,18,19,20,21)