4-(1H-imidazol-5-yl)-N-[(2-methylphenyl)methyl]piperidine-1-carbothioamide

Systemtic Name: 4-(1H-imidazol-5-yl)-N-[(2-methylphenyl)methyl]piperidine-1-carbothioamide Openeye Name: 4-(1H-imidazol-5-yl)-N-(o-tolylmethyl)piperidine-1-carbothioamide CAS Name: 4-(1H-imidazol-5-yl)-N-[(2-methylphenyl)methyl]-1-piperidinecarbothioamide IUPAC Name: 4-(1H-imidazol-5-yl)-N-[(2-methylphenyl)methyl]piperidine-1-carbothioamide Traditional Name: 4-(1H-imidazol-5-yl)-N-(2-methylbenzyl)piperidine-1-carbothioamide Formula: C17H22N4S MolecularWeight: 314.44838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=S)N2CCC(CC2)C3=CN=CN3

Isomeric SMILES

CC1=CC=CC=C1CNC(=S)N2CCC(CC2)C3=CN=CN3

InChI

InChI=1S/C17H22N4S/c1-13-4-2-3-5-15(13)10-19-17(22)21-8-6-14(7-9-21)16-11-18-12-20-16/h2-5,11-12,14H,6-10H2,1H3,(H,18,20)(H,19,22)