6-ethyl-1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-ethyl-1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-ethyl-1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-ethyl-1-methyl-3-(1-methyl-5-nitro-2-imidazolyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-ethyl-1-methyl-3-(1-methyl-5-nitroimidazol-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-ethyl-1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C12H13N7O3 MolecularWeight: 303.27672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=O)C2=C(NN(C2=N1)C)C3=NC=C(N3C)[N+](=O)[O-]

Isomeric SMILES

CCC1=NC(=O)C2=C(NN(C2=N1)C)C3=NC=C(N3C)[N+](=O)[O-]

InChI

InChI=1S/C12H13N7O3/c1-4-6-14-10-8(12(20)15-6)9(16-18(10)3)11-13-5-7(17(11)2)19(21)22/h5,16H,4H2,1-3H3