N'-[6-[(4-butoxyphenyl)amino]-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-ethanehydrazide

Systemtic Name: N'-[6-[(4-butoxyphenyl)amino]-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-ethanehydrazide Openeye Name: N'-[6-(4-butoxyanilino)-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-acetohydrazide CAS Name: N'-[6-(4-butoxyanilino)-5-nitro-4-pyrimidinyl]-2,2-diphenylacetohydrazide IUPAC Name: N'-[6-(4-butoxyanilino)-5-nitropyrimidin-4-yl]-2,2-diphenylacetohydrazide Traditional Name: N'-[6-(4-butoxyanilino)-5-nitro-pyrimidin-4-yl]-2,2-diphenyl-acetohydrazide Formula: C28H28N6O4 MolecularWeight: 512.55972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=C(C(=NC=N2)NNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C28H28N6O4/c1-2-3-18-38-23-16-14-22(15-17-23)31-26-25(34(36)37)27(30-19-29-26)32-33-28(35)24(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-17,19,24H,2-3,18H2,1H3,(H,33,35)(H2,29,30,31,32)