N2,N2-diethyl-N4-(4-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine

Systemtic Name: N2,N2-diethyl-N4-(4-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N2,N2-diethyl-N4-(4-fluorophenyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N2,N2-diethyl-N4-(4-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 2-N,2-N-diethyl-4-N-(4-fluorophenyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(4-fluoroanilino)-5-nitro-pyrimidin-2-yl]-diethyl-amine Formula: C14H17FN6O2 MolecularWeight: 320.322183

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=C(C(=N1)NC2=CC=C(C=C2)F)[N+](=O)[O-])N

Isomeric SMILES

CCN(CC)C1=NC(=C(C(=N1)NC2=CC=C(C=C2)F)[N+](=O)[O-])N

InChI

InChI=1S/C14H17FN6O2/c1-3-20(4-2)14-18-12(16)11(21(22)23)13(19-14)17-10-7-5-9(15)6-8-10/h5-8H,3-4H2,1-2H3,(H3,16,17,18,19)