N4-[2,5-bis(fluoranyl)phenyl]-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-[2,5-bis(fluoranyl)phenyl]-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2,5-difluorophenyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2,5-difluorophenyl)-N6-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2,5-difluorophenyl)-6-N-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2,5-difluoroanilino)-5-nitro-pyrimidin-4-yl]-(3-methoxypropyl)amine Formula: C14H15F2N5O3 MolecularWeight: 339.297406

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=CC(=C2)F)F

Isomeric SMILES

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=C(C=CC(=C2)F)F

InChI

InChI=1S/C14H15F2N5O3/c1-24-6-2-5-17-13-12(21(22)23)14(19-8-18-13)20-11-7-9(15)3-4-10(11)16/h3-4,7-8H,2,5-6H2,1H3,(H2,17,18,19,20)