4-(6-chloranyl-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide

Systemtic Name: 4-(6-chloranyl-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide Openeye Name: 4-(6-chloro-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide CAS Name: 4-(6-chloro-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)-1-piperidinecarbothioamide IUPAC Name: 4-(6-chloro-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide Traditional Name: 4-(6-chloro-1H-benzimidazol-2-yl)-N-(3,5-dimethylphenyl)piperidine-1-carbothioamide Formula: C21H23ClN4S MolecularWeight: 398.95212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)C3=NC4=C(N3)C=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)N2CCC(CC2)C3=NC4=C(N3)C=C(C=C4)Cl)C

InChI

InChI=1S/C21H23ClN4S/c1-13-9-14(2)11-17(10-13)23-21(27)26-7-5-15(6-8-26)20-24-18-4-3-16(22)12-19(18)25-20/h3-4,9-12,15H,5-8H2,1-2H3,(H,23,27)(H,24,25)