N6-pyridin-4-yl-N4-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine

Systemtic Name: N6-pyridin-4-yl-N4-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine Openeye Name: N6-(4-pyridyl)-N4-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine CAS Name: N6-pyridin-4-yl-N4-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine IUPAC Name: 6-N-pyridin-4-yl-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-pyridylamino)pyrimidin-4-yl]-[3-(trifluoromethyl)phenyl]amine Formula: C16H13F3N6 MolecularWeight: 346.30983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C(C(=NC=N2)NC3=CC=NC=C3)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C(C(=NC=N2)NC3=CC=NC=C3)N)C(F)(F)F

InChI

InChI=1S/C16H13F3N6/c17-16(18,19)10-2-1-3-12(8-10)25-15-13(20)14(22-9-23-15)24-11-4-6-21-7-5-11/h1-9H,20H2,(H2,21,22,23,24,25)