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

Systemtic Name: N'-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide Openeye Name: N'-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide CAS Name: N'-[6-[4-(4-methoxyphenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]-4-pyridinecarbohydrazide IUPAC Name: N'-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]pyridine-4-carbohydrazide Traditional Name: N'-[6-[4-(4-methoxyphenyl)piperazino]-5-nitro-pyrimidin-4-yl]isonicotinohydrazide Formula: C21H22N8O4 MolecularWeight: 450.45058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NC=N3)NNC(=O)C4=CC=NC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C3=C(C(=NC=N3)NNC(=O)C4=CC=NC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N8O4/c1-33-17-4-2-16(3-5-17)27-10-12-28(13-11-27)20-18(29(31)32)19(23-14-24-20)25-26-21(30)15-6-8-22-9-7-15/h2-9,14H,10-13H2,1H3,(H,26,30)(H,23,24,25)