N-(2,3-dimethylphenyl)-4-[methyl-(2-methylcyclohexyl)amino]piperidine-1-carbothioamide

Systemtic Name: N-(2,3-dimethylphenyl)-4-[methyl-(2-methylcyclohexyl)amino]piperidine-1-carbothioamide Openeye Name: N-(2,3-dimethylphenyl)-4-[methyl-(2-methylcyclohexyl)amino]piperidine-1-carbothioamide CAS Name: N-(2,3-dimethylphenyl)-4-[methyl-(2-methylcyclohexyl)amino]-1-piperidinecarbothioamide IUPAC Name: N-(2,3-dimethylphenyl)-4-[methyl-(2-methylcyclohexyl)amino]piperidine-1-carbothioamide Traditional Name: N-(2,3-dimethylphenyl)-4-[methyl-(2-methylcyclohexyl)amino]piperidine-1-carbothioamide Formula: C22H35N3S MolecularWeight: 373.5984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N(C)C2CCN(CC2)C(=S)NC3=CC=CC(=C3C)C

Isomeric SMILES

CC1CCCCC1N(C)C2CCN(CC2)C(=S)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C22H35N3S/c1-16-9-7-10-20(18(16)3)23-22(26)25-14-12-19(13-15-25)24(4)21-11-6-5-8-17(21)2/h7,9-10,17,19,21H,5-6,8,11-15H2,1-4H3,(H,23,26)