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

Systemtic Name: N'-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide Openeye Name: N'-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-3-carbohydrazide CAS Name: N'-[6-[4-(4-methoxyphenyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]-3-pyridinecarbohydrazide IUPAC Name: N'-[6-[4-(4-methoxyphenyl)piperazin-1-yl]-5-nitropyrimidin-4-yl]pyridine-3-carbohydrazide Traditional Name: N'-[6-[4-(4-methoxyphenyl)piperazino]-5-nitro-pyrimidin-4-yl]nicotinohydrazide 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=CN=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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