N4-(3-fluorophenyl)-N2-(4-methoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N4-(3-fluorophenyl)-N2-(4-methoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N4-(3-fluorophenyl)-N2-(4-methoxyphenyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N4-(3-fluorophenyl)-N2-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 4-N-(3-fluorophenyl)-2-N-(4-methoxyphenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(3-fluoroanilino)-5-nitro-pyrimidin-2-yl]-(4-methoxyphenyl)amine Formula: C17H15FN6O3 MolecularWeight: 370.337803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=C(C(=N2)NC3=CC(=CC=C3)F)[N+](=O)[O-])N

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=C(C(=N2)NC3=CC(=CC=C3)F)[N+](=O)[O-])N

InChI

InChI=1S/C17H15FN6O3/c1-27-13-7-5-11(6-8-13)21-17-22-15(19)14(24(25)26)16(23-17)20-12-4-2-3-10(18)9-12/h2-9H,1H3,(H4,19,20,21,22,23)