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

Systemtic Name: N'-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide Openeye Name: N'-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide CAS Name: N'-[6-[4-(3-chlorophenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]-3-pyridinecarbohydrazide IUPAC Name: N'-[6-[4-(3-chlorophenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]pyridine-3-carbohydrazide Traditional Name: N'-[6-[4-(3-chlorophenyl)piperazino]-5-nitro-pyrimidin-4-yl]nicotinohydrazide Formula: C20H19ClN8O3 MolecularWeight: 454.86966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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