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

Systemtic Name: N4-(2-fluorophenyl)-N6-(4-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-fluorophenyl)-N6-(4-methoxyphenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-fluorophenyl)-N6-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2-fluorophenyl)-6-N-(4-methoxyphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2-fluoroanilino)-5-nitro-pyrimidin-4-yl]-(4-methoxyphenyl)amine Formula: C17H14FN5O3 MolecularWeight: 355.323163

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC=C3F)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC2=C(C(=NC=N2)NC3=CC=CC=C3F)[N+](=O)[O-]

InChI

InChI=1S/C17H14FN5O3/c1-26-12-8-6-11(7-9-12)21-16-15(23(24)25)17(20-10-19-16)22-14-5-3-2-4-13(14)18/h2-10H,1H3,(H2,19,20,21,22)