2-(4-nitroimidazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-(4-nitroimidazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-(4-nitroimidazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-(4-nitro-1-imidazolyl)-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-(4-nitroimidazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-(4-nitroimidazol-1-yl)-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C13H15N7O3 MolecularWeight: 317.3033

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H15N7O3/c21-12(9-17-8-11(16-10-17)20(22)23)18-4-6-19(7-5-18)13-14-2-1-3-15-13/h1-3,8,10H,4-7,9H2