N4,N4-diethyl-N6-(4-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine

Systemtic Name: N4,N4-diethyl-N6-(4-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine Openeye Name: N4,N4-diethyl-N6-(4-fluorophenyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N4,N4-diethyl-N6-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-diethyl-6-N-(4-fluorophenyl)-5-nitropyrimidine-4,6-diamine Traditional Name: diethyl-[6-(4-fluoroanilino)-5-nitro-pyrimidin-4-yl]amine Formula: C14H16FN5O2 MolecularWeight: 305.307543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16FN5O2/c1-3-19(4-2)14-12(20(21)22)13(16-9-17-14)18-11-7-5-10(15)6-8-11/h5-9H,3-4H2,1-2H3,(H,16,17,18)