N6-(4-fluorophenyl)-N4-(2-methylphenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N6-(4-fluorophenyl)-N4-(2-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N6-(4-fluorophenyl)-5-nitro-N4-(o-tolyl)pyrimidine-4,6-diamine CAS Name: N6-(4-fluorophenyl)-N4-(2-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 6-N-(4-fluorophenyl)-4-N-(2-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(4-fluoroanilino)-5-nitro-pyrimidin-4-yl]-(o-tolyl)amine Formula: C17H14FN5O2 MolecularWeight: 339.323763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC=C1NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=C(C=C3)F

InChI

InChI=1S/C17H14FN5O2/c1-11-4-2-3-5-14(11)22-17-15(23(24)25)16(19-10-20-17)21-13-8-6-12(18)7-9-13/h2-10H,1H3,(H2,19,20,21,22)