N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-methyl-benzamide

Systemtic Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-methyl-benzamide Openeye Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-methyl-benzamide CAS Name: N-[4-[[[[3-(2-chlorophenyl)-1-oxopropyl]amino]-sulfanylidenemethyl]amino]phenyl]-3-methylbenzamide IUPAC Name: N-[4-[3-(2-chlorophenyl)propanoylcarbamothioylamino]phenyl]-3-methylbenzamide Traditional Name: N-[4-[3-(2-chlorophenyl)propanoylthiocarbamoylamino]phenyl]-3-methyl-benzamide Formula: C24H22ClN3O2S MolecularWeight: 451.96838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)NC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

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