6-(2-tert-butylhydrazinyl)-N-[(4-methylphenyl)methyl]-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(2-tert-butylhydrazinyl)-N-[(4-methylphenyl)methyl]-5-nitro-pyrimidin-4-amine Openeye Name: 6-(2-tert-butylhydrazino)-5-nitro-N-(p-tolylmethyl)pyrimidin-4-amine CAS Name: 6-(tert-butylhydrazo)-N-[(4-methylphenyl)methyl]-5-nitro-4-pyrimidinamine IUPAC Name: 6-(2-tert-butylhydrazinyl)-N-[(4-methylphenyl)methyl]-5-nitropyrimidin-4-amine Traditional Name: [6-(N'-tert-butylhydrazino)-5-nitro-pyrimidin-4-yl]-(4-methylbenzyl)amine Formula: C16H22N6O2 MolecularWeight: 330.38488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NNC(C)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)CNC2=C(C(=NC=N2)NNC(C)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C16H22N6O2/c1-11-5-7-12(8-6-11)9-17-14-13(22(23)24)15(19-10-18-14)20-21-16(2,3)4/h5-8,10,21H,9H2,1-4H3,(H2,17,18,19,20)