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

Systemtic Name: N4-[2,5-bis(fluoranyl)phenyl]-N6-(2-methylphenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2,5-difluorophenyl)-5-nitro-N6-(o-tolyl)pyrimidine-4,6-diamine CAS Name: N4-(2,5-difluorophenyl)-N6-(2-methylphenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2,5-difluorophenyl)-6-N-(2-methylphenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2,5-difluoroanilino)-5-nitro-pyrimidin-4-yl]-(o-tolyl)amine Formula: C17H13F2N5O2 MolecularWeight: 357.314226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=C(C=CC(=C3)F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC2=C(C(=NC=N2)NC3=C(C=CC(=C3)F)F)[N+](=O)[O-]

InChI

InChI=1S/C17H13F2N5O2/c1-10-4-2-3-5-13(10)22-16-15(24(25)26)17(21-9-20-16)23-14-8-11(18)6-7-12(14)19/h2-9H,1H3,(H2,20,21,22,23)