2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[4-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]propanamide

Systemtic Name: 2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[4-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]propanamide Openeye Name: 2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[2-(4-methylpiperazin-1-yl)-4-(o-tolyl)pyrimidin-5-yl]propanamide CAS Name: 2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[4-(2-methylphenyl)-2-(4-methyl-1-piperazinyl)-5-pyrimidinyl]propanamide IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[4-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]propanamide Traditional Name: 2-[3,5-bis(trifluoromethyl)phenyl]-N,2-dimethyl-N-[2-(4-methylpiperazino)-4-(o-tolyl)pyrimidin-5-yl]propionamide Formula: C29H31F6N5O MolecularWeight: 579.579759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=NC=C2N(C)C(=O)C(C)(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCN(CC4)C

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=NC=C2N(C)C(=O)C(C)(C)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCN(CC4)C

InChI

InChI=1S/C29H31F6N5O/c1-18-8-6-7-9-22(18)24-23(17-36-26(37-24)40-12-10-38(4)11-13-40)39(5)25(41)27(2,3)19-14-20(28(30,31)32)16-21(15-19)29(33,34)35/h6-9,14-17H,10-13H2,1-5H3