N-(3-chlorophenyl)-5-[(pentylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine

Systemtic Name: N-(3-chlorophenyl)-5-[(pentylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Openeye Name: N-(3-chlorophenyl)-5-[(pentylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine CAS Name: N-(3-chlorophenyl)-5-[(pentylamino)methyl]-4-(trifluoromethyl)-2-pyrimidinamine IUPAC Name: N-(3-chlorophenyl)-5-[(pentylamino)methyl]-4-(trifluoromethyl)pyrimidin-2-amine Traditional Name: amyl-[[2-(3-chloroanilino)-4-(trifluoromethyl)pyrimidin-5-yl]methyl]amine Formula: C17H20ClF3N4 MolecularWeight: 372.81571

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNCC1=CN=C(N=C1C(F)(F)F)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CCCCCNCC1=CN=C(N=C1C(F)(F)F)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C17H20ClF3N4/c1-2-3-4-8-22-10-12-11-23-16(25-15(12)17(19,20)21)24-14-7-5-6-13(18)9-14/h5-7,9,11,22H,2-4,8,10H2,1H3,(H,23,24,25)