N'-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]pyridine-3-carbohydrazide

Systemtic Name: N'-[5-nitro-6-[4-(phenylmethyl)piperazin-1-yl]pyrimidin-4-yl]pyridine-3-carbohydrazide Openeye Name: N'-[6-(4-benzylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide CAS Name: N'-[5-nitro-6-[4-(phenylmethyl)-1-piperazinyl]-4-pyrimidinyl]-3-pyridinecarbohydrazide IUPAC Name: N'-[6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-yl]pyridine-3-carbohydrazide Traditional Name: N'-[6-(4-benzylpiperazino)-5-nitro-pyrimidin-4-yl]nicotinohydrazide Formula: C21H22N8O3 MolecularWeight: 434.45118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)NNC(=O)C4=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)NNC(=O)C4=CN=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N8O3/c30-21(17-7-4-8-22-13-17)26-25-19-18(29(31)32)20(24-15-23-19)28-11-9-27(10-12-28)14-16-5-2-1-3-6-16/h1-8,13,15H,9-12,14H2,(H,26,30)(H,23,24,25)