N4-(3-fluorophenyl)-5-nitro-N2-[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4,6-triamine

Systemtic Name: N4-(3-fluorophenyl)-5-nitro-N2-[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4,6-triamine Openeye Name: N4-(3-fluorophenyl)-5-nitro-N2-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrimidine-2,4,6-triamine CAS Name: N4-(3-fluorophenyl)-5-nitro-N2-[[(2R)-2-oxolanyl]methyl]pyrimidine-2,4,6-triamine IUPAC Name: 4-N-(3-fluorophenyl)-5-nitro-2-N-[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4,6-triamine Traditional Name: [4-amino-6-(3-fluoroanilino)-5-nitro-pyrimidin-2-yl]-[[(2R)-tetrahydrofuran-2-yl]methyl]amine Formula: C15H17FN6O3 MolecularWeight: 348.332283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC2=NC(=C(C(=N2)NC3=CC(=CC=C3)F)[N+](=O)[O-])N

Isomeric SMILES

C1C[C@@H](OC1)CNC2=NC(=C(C(=N2)NC3=CC(=CC=C3)F)[N+](=O)[O-])N

InChI

InChI=1S/C15H17FN6O3/c16-9-3-1-4-10(7-9)19-14-12(22(23)24)13(17)20-15(21-14)18-8-11-5-2-6-25-11/h1,3-4,7,11H,2,5-6,8H2,(H4,17,18,19,20,21)/t11-/m1/s1