6-(3-methoxyphenyl)-N4-[4-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine

Systemtic Name: 6-(3-methoxyphenyl)-N4-[4-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine Openeye Name: 6-(3-methoxyphenyl)-N4-[4-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine CAS Name: 6-(3-methoxyphenyl)-N4-[4-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine IUPAC Name: 6-(3-methoxyphenyl)-4-N-[4-(trifluoromethyl)phenyl]pyrimidine-4,5-diamine Traditional Name: [5-amino-6-(3-methoxyphenyl)pyrimidin-4-yl]-[4-(trifluoromethyl)phenyl]amine Formula: C18H15F3N4O MolecularWeight: 360.33311

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C(=NC=N2)NC3=CC=C(C=C3)C(F)(F)F)N

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C(=NC=N2)NC3=CC=C(C=C3)C(F)(F)F)N

InChI

InChI=1S/C18H15F3N4O/c1-26-14-4-2-3-11(9-14)16-15(22)17(24-10-23-16)25-13-7-5-12(6-8-13)18(19,20)21/h2-10H,22H2,1H3,(H,23,24,25)