4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]-N-[4-pyridin-3-yl-3-(trifluoromethyl)phenyl]benzamide

Systemtic Name: 4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]-N-[4-pyridin-3-yl-3-(trifluoromethyl)phenyl]benzamide Openeye Name: 4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]-N-[4-(3-pyridyl)-3-(trifluoromethyl)phenyl]benzamide CAS Name: 4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]-N-[4-(3-pyridinyl)-3-(trifluoromethyl)phenyl]benzamide IUPAC Name: 4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]-N-[4-pyridin-3-yl-3-(trifluoromethyl)phenyl]benzamide Traditional Name: 4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]-N-[4-(3-pyridyl)-3-(trifluoromethyl)phenyl]benzamide Formula: C29H21F3N6O MolecularWeight: 526.51185

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)C3=CN=CC=C3)C(F)(F)F)NC4=NC=CC(=N4)C5=CN=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)C3=CN=CC=C3)C(F)(F)F)NC4=NC=CC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C29H21F3N6O/c1-18-6-7-19(14-26(18)38-28-35-13-10-25(37-28)21-5-3-12-34-17-21)27(39)36-22-8-9-23(20-4-2-11-33-16-20)24(15-22)29(30,31)32/h2-17H,1H3,(H,36,39)(H,35,37,38)