N-(3-chloranyl-4-methyl-phenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide CAS Name: N-(3-chloro-4-methylphenyl)-4-[cycloheptyl(methyl)amino]-1-piperidinecarbothioamide IUPAC Name: N-(3-chloro-4-methylphenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-4-[cycloheptyl(methyl)amino]piperidine-1-carbothioamide Formula: C21H32ClN3S MolecularWeight: 394.01688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N2CCC(CC2)N(C)C3CCCCCC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N2CCC(CC2)N(C)C3CCCCCC3)Cl

InChI

InChI=1S/C21H32ClN3S/c1-16-9-10-17(15-20(16)22)23-21(26)25-13-11-19(12-14-25)24(2)18-7-5-3-4-6-8-18/h9-10,15,18-19H,3-8,11-14H2,1-2H3,(H,23,26)