3-[(4-methylphenyl)carbamothioylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 3-[(4-methylphenyl)carbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-(p-tolylcarbamothioylamino)benzamide CAS Name: 3-[[(4-methylanilino)-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-[(4-methylphenyl)carbamothioylamino]benzamide Traditional Name: N-benzyl-3-(p-tolylthiocarbamoylamino)benzamide Formula: C22H21N3OS MolecularWeight: 375.48664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C22H21N3OS/c1-16-10-12-19(13-11-16)24-22(27)25-20-9-5-8-18(14-20)21(26)23-15-17-6-3-2-4-7-17/h2-14H,15H2,1H3,(H,23,26)(H2,24,25,27)