N-[1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)pyrazolo[3,4-d]pyrimidin-4-yl]ethanamide

Systemtic Name: N-[1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)pyrazolo[3,4-d]pyrimidin-4-yl]ethanamide Openeye Name: N-[1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)pyrazolo[3,4-d]pyrimidin-4-yl]acetamide CAS Name: N-[1-methyl-3-(1-methyl-5-nitro-2-imidazolyl)-4-pyrazolo[3,4-d]pyrimidinyl]acetamide IUPAC Name: N-[1-methyl-3-(1-methyl-5-nitroimidazol-2-yl)pyrazolo[3,4-d]pyrimidin-4-yl]acetamide Traditional Name: N-[1-methyl-3-(1-methyl-5-nitro-imidazol-2-yl)pyrazolo[3,4-d]pyrimidin-4-yl]acetamide Formula: C12H12N8O3 MolecularWeight: 316.27548

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC=NC2=C1C(=NN2C)C3=NC=C(N3C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=NC=NC2=C1C(=NN2C)C3=NC=C(N3C)[N+](=O)[O-]

InChI

InChI=1S/C12H12N8O3/c1-6(21)16-10-8-9(17-19(3)11(8)15-5-14-10)12-13-4-7(18(12)2)20(22)23/h4-5H,1-3H3,(H,14,15,16,21)