N4-(2-fluorophenyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4-(2-fluorophenyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4-(2-fluorophenyl)-N6-(3-methoxypropyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4-(2-fluorophenyl)-N6-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N-(2-fluorophenyl)-6-N-(3-methoxypropyl)-5-nitropyrimidine-4,6-diamine Traditional Name: [6-(2-fluoroanilino)-5-nitro-pyrimidin-4-yl]-(3-methoxypropyl)amine Formula: C14H16FN5O3 MolecularWeight: 321.306943

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC=C2F

Isomeric SMILES

COCCCNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC=C2F

InChI

InChI=1S/C14H16FN5O3/c1-23-8-4-7-16-13-12(20(21)22)14(18-9-17-13)19-11-6-3-2-5-10(11)15/h2-3,5-6,9H,4,7-8H2,1H3,(H2,16,17,18,19)