N'-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]benzohydrazide

Systemtic Name: N'-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]benzohydrazide Openeye Name: N'-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]benzohydrazide CAS Name: N'-[6-(4-ethyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]benzohydrazide IUPAC Name: N'-[6-(4-ethylpiperazin-1-yl)-5-nitropyrimidin-4-yl]benzohydrazide Traditional Name: N'-[6-(4-ethylpiperazino)-5-nitro-pyrimidin-4-yl]benzohydrazide Formula: C17H21N7O3 MolecularWeight: 371.39374

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=NC=N2)NNC(=O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N7O3/c1-2-22-8-10-23(11-9-22)16-14(24(26)27)15(18-12-19-16)20-21-17(25)13-6-4-3-5-7-13/h3-7,12H,2,8-11H2,1H3,(H,21,25)(H,18,19,20)