3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-N-(3-methylphenyl)benzamide Openeye Name: 3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-N-(m-tolyl)benzamide CAS Name: 3-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 3-[3-(2-chlorophenyl)propanoylcarbamothioylamino]-N-(3-methylphenyl)benzamide Traditional Name: 3-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]-N-(m-tolyl)benzamide Formula: C24H22ClN3O2S MolecularWeight: 451.96838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C24H22ClN3O2S/c1-16-6-4-9-19(14-16)26-23(30)18-8-5-10-20(15-18)27-24(31)28-22(29)13-12-17-7-2-3-11-21(17)25/h2-11,14-15H,12-13H2,1H3,(H,26,30)(H2,27,28,29,31)