N-(3-chlorophenyl)-4-(4-methylphenyl)carbonyl-piperidine-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-4-(4-methylphenyl)carbonyl-piperidine-1-carbothioamide Openeye Name: N-(3-chlorophenyl)-4-(4-methylbenzoyl)piperidine-1-carbothioamide CAS Name: N-(3-chlorophenyl)-4-[(4-methylphenyl)-oxomethyl]-1-piperidinecarbothioamide IUPAC Name: N-(3-chlorophenyl)-4-(4-methylbenzoyl)piperidine-1-carbothioamide Traditional Name: N-(3-chlorophenyl)-4-p-toluoyl-piperidine-1-carbothioamide Formula: C20H21ClN2OS MolecularWeight: 372.91154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=S)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2CCN(CC2)C(=S)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C20H21ClN2OS/c1-14-5-7-15(8-6-14)19(24)16-9-11-23(12-10-16)20(25)22-18-4-2-3-17(21)13-18/h2-8,13,16H,9-12H2,1H3,(H,22,25)