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

Systemtic Name: N'-[6-[4-(diphenylmethyl)piperazin-1-yl]-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide Openeye Name: N'-[6-(4-benzhydrylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]pyridine-4-carbohydrazide CAS Name: N'-[6-[4-(diphenylmethyl)-1-piperazinyl]-5-nitro-4-pyrimidinyl]-4-pyridinecarbohydrazide IUPAC Name: N'-[6-(4-benzhydrylpiperazin-1-yl)-5-nitropyrimidin-4-yl]pyridine-4-carbohydrazide Traditional Name: N'-[6-(4-benzhydrylpiperazino)-5-nitro-pyrimidin-4-yl]isonicotinohydrazide Formula: C27H26N8O3 MolecularWeight: 510.54714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NC=N2)NNC(=O)C3=CC=NC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=C(C(=NC=N2)NNC(=O)C3=CC=NC=C3)[N+](=O)[O-])C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H26N8O3/c36-27(22-11-13-28-14-12-22)32-31-25-24(35(37)38)26(30-19-29-25)34-17-15-33(16-18-34)23(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-14,19,23H,15-18H2,(H,32,36)(H,29,30,31)