N-(3-fluorophenyl)-5-[(2-methylpropylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-(3-fluorophenyl)-5-[(2-methylpropylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-(3-fluorophenyl)-5-[(isobutylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-(3-fluorophenyl)-5-[(2-methylpropylamino)methyl]-4-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(3-fluorophenyl)-5-[(2-methylpropylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Traditional Name: [2-(3-fluoroanilino)-4-(trifluoromethyl)pyrimidin-5-yl]methyl-isobutyl-amine Formula: C16H18F4N4 MolecularWeight: 342.334533

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCC1=CN=C(N=C1C(F)(F)F)NC2=CC(=CC=C2)F

Isomeric SMILES

CC(C)CNCC1=CN=C(N=C1C(F)(F)F)NC2=CC(=CC=C2)F

InChI

InChI=1S/C16H18F4N4/c1-10(2)7-21-8-11-9-22-15(24-14(11)16(18,19)20)23-13-5-3-4-12(17)6-13/h3-6,9-10,21H,7-8H2,1-2H3,(H,22,23,24)