N'-[6-(1,3-benzodioxol-5-ylmethylamino)-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-ethanehydrazide

Systemtic Name: N'-[6-(1,3-benzodioxol-5-ylmethylamino)-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-ethanehydrazide Openeye Name: N'-[6-(1,3-benzodioxol-5-ylmethylamino)-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-acetohydrazide CAS Name: N'-[6-(1,3-benzodioxol-5-ylmethylamino)-5-nitro-4-pyrimidinyl]-2,2-diphenylacetohydrazide IUPAC Name: N'-[6-(1,3-benzodioxol-5-ylmethylamino)-5-nitropyrimidin-4-yl]-2,2-diphenylacetohydrazide Traditional Name: N'-[5-nitro-6-(piperonylamino)pyrimidin-4-yl]-2,2-diphenyl-acetohydrazide Formula: C26H22N6O5 MolecularWeight: 498.49008

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=NC=N3)NNC(=O)C(C4=CC=CC=C4)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=C(C(=NC=N3)NNC(=O)C(C4=CC=CC=C4)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H22N6O5/c33-26(22(18-7-3-1-4-8-18)19-9-5-2-6-10-19)31-30-25-23(32(34)35)24(28-15-29-25)27-14-17-11-12-20-21(13-17)37-16-36-20/h1-13,15,22H,14,16H2,(H,31,33)(H2,27,28,29,30)