6-(3-imidazol-1-ylpropylamino)-5-nitro-1H-pyrimidin-4-one

Systemtic Name: 6-(3-imidazol-1-ylpropylamino)-5-nitro-1H-pyrimidin-4-one Openeye Name: 6-(3-imidazol-1-ylpropylamino)-5-nitro-1H-pyrimidin-4-one CAS Name: 6-[3-(1-imidazolyl)propylamino]-5-nitro-1H-pyrimidin-4-one IUPAC Name: 6-(3-imidazol-1-ylpropylamino)-5-nitro-1H-pyrimidin-4-one Traditional Name: 6-(3-imidazol-1-ylpropylamino)-5-nitro-1H-pyrimidin-4-one Formula: C10H12N6O3 MolecularWeight: 264.24068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCCNC2=C(C(=O)N=CN2)[N+](=O)[O-]

Isomeric SMILES

C1=CN(C=N1)CCCNC2=C(C(=O)N=CN2)[N+](=O)[O-]

InChI

InChI=1S/C10H12N6O3/c17-10-8(16(18)19)9(13-6-14-10)12-2-1-4-15-5-3-11-7-15/h3,5-7H,1-2,4H2,(H2,12,13,14,17)