N4-[2,5-bis(fluoranyl)phenyl]-N6-(5-methylpyridin-2-yl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[2,5-bis(fluoranyl)phenyl]-N6-(5-methylpyridin-2-yl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2,5-difluorophenyl)-N6-(5-methyl-2-pyridyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2,5-difluorophenyl)-N6-(5-methyl-2-pyridinyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2,5-difluorophenyl)-6-N-(5-methylpyridin-2-yl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2,5-difluoroanilino)-5-nitro-pyrimidin-4-yl]-(5-methyl-2-pyridyl)amine Formula: C16H12F2N6O2 MolecularWeight: 358.302286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=CC(=C3)F)F

Isomeric SMILES

CC1=CN=C(C=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=C(C=CC(=C3)F)F

InChI

InChI=1S/C16H12F2N6O2/c1-9-2-5-13(19-7-9)23-16-14(24(25)26)15(20-8-21-16)22-12-6-10(17)3-4-11(12)18/h2-8H,1H3,(H2,19,20,21,22,23)