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

Systemtic Name: N4-(4-fluorophenyl)-N2-(furan-2-ylmethyl)-5-nitro-pyrimidine-2,4,6-triamine Openeye Name: N4-(4-fluorophenyl)-N2-(2-furylmethyl)-5-nitro-pyrimidine-2,4,6-triamine CAS Name: N4-(4-fluorophenyl)-N2-(2-furanylmethyl)-5-nitropyrimidine-2,4,6-triamine IUPAC Name: 4-N-(4-fluorophenyl)-2-N-(furan-2-ylmethyl)-5-nitropyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(4-fluoroanilino)-5-nitro-pyrimidin-2-yl]-(2-furfuryl)amine Formula: C15H13FN6O3 MolecularWeight: 344.300523

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=NC(=C(C(=N2)NC3=CC=C(C=C3)F)[N+](=O)[O-])N

Isomeric SMILES

C1=COC(=C1)CNC2=NC(=C(C(=N2)NC3=CC=C(C=C3)F)[N+](=O)[O-])N

InChI

InChI=1S/C15H13FN6O3/c16-9-3-5-10(6-4-9)19-14-12(22(23)24)13(17)20-15(21-14)18-8-11-2-1-7-25-11/h1-7H,8H2,(H4,17,18,19,20,21)