3-chloranyl-N'-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide

Systemtic Name: 3-chloranyl-N'-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide Openeye Name: 3-chloro-N'-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide CAS Name: 3-chloro-N'-[5-nitro-6-(4-phenyl-1-piperazinyl)-4-pyrimidinyl]benzohydrazide IUPAC Name: 3-chloro-N'-[5-nitro-6-(4-phenylpiperazin-1-yl)pyrimidin-4-yl]benzohydrazide Traditional Name: 3-chloro-N'-[5-nitro-6-(4-phenylpiperazino)pyrimidin-4-yl]benzohydrazide Formula: C21H20ClN7O3 MolecularWeight: 453.8816

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)NNC(=O)C4=CC(=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C(=NC=N3)NNC(=O)C4=CC(=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClN7O3/c22-16-6-4-5-15(13-16)21(30)26-25-19-18(29(31)32)20(24-14-23-19)28-11-9-27(10-12-28)17-7-2-1-3-8-17/h1-8,13-14H,9-12H2,(H,26,30)(H,23,24,25)