N2-(1,3-benzodioxol-5-ylmethyl)-N4-pyridin-4-yl-6-(trifluoromethyl)pyrimidine-2,4-diamine

Systemtic Name: N2-(1,3-benzodioxol-5-ylmethyl)-N4-pyridin-4-yl-6-(trifluoromethyl)pyrimidine-2,4-diamine Openeye Name: N2-(1,3-benzodioxol-5-ylmethyl)-N4-(4-pyridyl)-6-(trifluoromethyl)pyrimidine-2,4-diamine CAS Name: N2-(1,3-benzodioxol-5-ylmethyl)-N4-pyridin-4-yl-6-(trifluoromethyl)pyrimidine-2,4-diamine IUPAC Name: 2-N-(1,3-benzodioxol-5-ylmethyl)-4-N-pyridin-4-yl-6-(trifluoromethyl)pyrimidine-2,4-diamine Traditional Name: piperonyl-[4-(4-pyridylamino)-6-(trifluoromethyl)pyrimidin-2-yl]amine Formula: C18H14F3N5O2 MolecularWeight: 389.33127

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=CC(=N3)NC4=CC=NC=C4)C(F)(F)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=CC(=N3)NC4=CC=NC=C4)C(F)(F)F

InChI

InChI=1S/C18H14F3N5O2/c19-18(20,21)15-8-16(24-12-3-5-22-6-4-12)26-17(25-15)23-9-11-1-2-13-14(7-11)28-10-27-13/h1-8H,9-10H2,(H2,22,23,24,25,26)