4-[(2-methylphenyl)methyl]-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-[(2-methylphenyl)methyl]-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-(o-tolylmethyl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide CAS Name: 4-[(2-methylphenyl)methyl]-N-[2-(trifluoromethyl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(2-methylphenyl)methyl]-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-(2-methylbenzyl)-N-[2-(trifluoromethyl)phenyl]piperazine-1-carbothioamide Formula: C20H22F3N3S MolecularWeight: 393.46899

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=S)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H22F3N3S/c1-15-6-2-3-7-16(15)14-25-10-12-26(13-11-25)19(27)24-18-9-5-4-8-17(18)20(21,22)23/h2-9H,10-14H2,1H3,(H,24,27)