2-[2-[[4-azanyl-6-(furan-2-ylmethylamino)-5-nitro-pyrimidin-2-yl]amino]ethoxy]ethanol

Systemtic Name: 2-[2-[[4-azanyl-6-(furan-2-ylmethylamino)-5-nitro-pyrimidin-2-yl]amino]ethoxy]ethanol Openeye Name: 2-[2-[[4-amino-6-(2-furylmethylamino)-5-nitro-pyrimidin-2-yl]amino]ethoxy]ethanol CAS Name: 2-[2-[[4-amino-6-(2-furanylmethylamino)-5-nitro-2-pyrimidinyl]amino]ethoxy]ethanol IUPAC Name: 2-[2-[[4-amino-6-(furan-2-ylmethylamino)-5-nitropyrimidin-2-yl]amino]ethoxy]ethanol Traditional Name: 2-[2-[[4-amino-6-(2-furfurylamino)-5-nitro-pyrimidin-2-yl]amino]ethoxy]ethanol Formula: C13H18N6O5 MolecularWeight: 338.31922

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC2=NC(=NC(=C2[N+](=O)[O-])N)NCCOCCO

Isomeric SMILES

C1=COC(=C1)CNC2=NC(=NC(=C2[N+](=O)[O-])N)NCCOCCO

InChI

InChI=1S/C13H18N6O5/c14-11-10(19(21)22)12(16-8-9-2-1-5-24-9)18-13(17-11)15-3-6-23-7-4-20/h1-2,5,20H,3-4,6-8H2,(H4,14,15,16,17,18)