N-(4-methylphenyl)-6-piperidin-1-yl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidin-4-amine

Systemtic Name: N-(4-methylphenyl)-6-piperidin-1-yl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidin-4-amine Openeye Name: 6-(1-piperidyl)-N-(p-tolyl)-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidin-4-amine CAS Name: N-(4-methylphenyl)-6-(1-piperidinyl)-2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]-4-pyrimidinamine IUPAC Name: N-(4-methylphenyl)-6-piperidin-1-yl-2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]pyrimidin-4-amine Traditional Name: [6-piperidino-2-[4-[3-(trifluoromethyl)phenyl]piperazino]pyrimidin-4-yl]-(p-tolyl)amine Formula: C27H31F3N6 MolecularWeight: 496.57045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=C2)N3CCCCC3)N4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=C2)N3CCCCC3)N4CCN(CC4)C5=CC=CC(=C5)C(F)(F)F

InChI

InChI=1S/C27H31F3N6/c1-20-8-10-22(11-9-20)31-24-19-25(35-12-3-2-4-13-35)33-26(32-24)36-16-14-34(15-17-36)23-7-5-6-21(18-23)27(28,29)30/h5-11,18-19H,2-4,12-17H2,1H3,(H,31,32,33)