2-[[3-azanyl-3-(2-methylphenyl)propyl]amino]-3-methyl-6-pyridin-4-yl-5-[3-(trifluoromethyl)phenyl]pyrimidin-4-one

Systemtic Name: 2-[[3-azanyl-3-(2-methylphenyl)propyl]amino]-3-methyl-6-pyridin-4-yl-5-[3-(trifluoromethyl)phenyl]pyrimidin-4-one Openeye Name: 2-[[3-amino-3-(o-tolyl)propyl]amino]-3-methyl-6-(4-pyridyl)-5-[3-(trifluoromethyl)phenyl]pyrimidin-4-one CAS Name: 2-[[3-amino-3-(2-methylphenyl)propyl]amino]-3-methyl-6-pyridin-4-yl-5-[3-(trifluoromethyl)phenyl]-4-pyrimidinone IUPAC Name: 2-[[3-amino-3-(2-methylphenyl)propyl]amino]-3-methyl-6-pyridin-4-yl-5-[3-(trifluoromethyl)phenyl]pyrimidin-4-one Traditional Name: 2-[[3-amino-3-(o-tolyl)propyl]amino]-3-methyl-6-(4-pyridyl)-5-[3-(trifluoromethyl)phenyl]pyrimidin-4-one Formula: C27H26F3N5O MolecularWeight: 493.52345

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CCNC2=NC(=C(C(=O)N2C)C3=CC(=CC=C3)C(F)(F)F)C4=CC=NC=C4)N

Isomeric SMILES

CC1=CC=CC=C1C(CCNC2=NC(=C(C(=O)N2C)C3=CC(=CC=C3)C(F)(F)F)C4=CC=NC=C4)N

InChI

InChI=1S/C27H26F3N5O/c1-17-6-3-4-9-21(17)22(31)12-15-33-26-34-24(18-10-13-32-14-11-18)23(25(36)35(26)2)19-7-5-8-20(16-19)27(28,29)30/h3-11,13-14,16,22H,12,15,31H2,1-2H3,(H,33,34)