4-chloranyl-N'-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 4-chloranyl-N'-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide Openeye Name: 4-chloro-N'-[5-nitro-6-[4-(2-pyridyl)piperazin-1-yl]pyrimidin-4-yl]benzohydrazide CAS Name: 4-chloro-N'-[5-nitro-6-[4-(2-pyridinyl)-1-piperazinyl]-4-pyrimidinyl]benzohydrazide IUPAC Name: 4-chloro-N'-[5-nitro-6-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide Traditional Name: 4-chloro-N'-[5-nitro-6-[4-(2-pyridyl)piperazino]pyrimidin-4-yl]benzohydrazide Formula: C20H19ClN8O3 MolecularWeight: 454.86966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C3=C(C(=NC=N3)NNC(=O)C4=CC=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H19ClN8O3/c21-15-6-4-14(5-7-15)20(30)26-25-18-17(29(31)32)19(24-13-23-18)28-11-9-27(10-12-28)16-3-1-2-8-22-16/h1-8,13H,9-12H2,(H,26,30)(H,23,24,25)