N'-[6-(tert-butylamino)-5-nitro-pyrimidin-4-yl]-2-phenyl-ethanehydrazide

Systemtic Name: N'-[6-(tert-butylamino)-5-nitro-pyrimidin-4-yl]-2-phenyl-ethanehydrazide Openeye Name: N'-[6-(tert-butylamino)-5-nitro-pyrimidin-4-yl]-2-phenyl-acetohydrazide CAS Name: N'-[6-(tert-butylamino)-5-nitro-4-pyrimidinyl]-2-phenylacetohydrazide IUPAC Name: N'-[6-(tert-butylamino)-5-nitropyrimidin-4-yl]-2-phenylacetohydrazide Traditional Name: N'-[6-(tert-butylamino)-5-nitro-pyrimidin-4-yl]-2-phenyl-acetohydrazide Formula: C16H20N6O3 MolecularWeight: 344.3684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=C(C(=NC=N1)NNC(=O)CC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC1=C(C(=NC=N1)NNC(=O)CC2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H20N6O3/c1-16(2,3)19-14-13(22(24)25)15(18-10-17-14)21-20-12(23)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3,(H,20,23)(H2,17,18,19,21)