N4,N4-bis(2-methylpropyl)-5-nitro-N6-pyridin-4-yl-pyrimidine-4,6-diamine

Systemtic Name: N4,N4-bis(2-methylpropyl)-5-nitro-N6-pyridin-4-yl-pyrimidine-4,6-diamine Openeye Name: N4,N4-diisobutyl-5-nitro-N6-(4-pyridyl)pyrimidine-4,6-diamine CAS Name: N4,N4-bis(2-methylpropyl)-5-nitro-N6-pyridin-4-ylpyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-bis(2-methylpropyl)-5-nitro-6-N-pyridin-4-ylpyrimidine-4,6-diamine Traditional Name: diisobutyl-[5-nitro-6-(4-pyridylamino)pyrimidin-4-yl]amine Formula: C17H24N6O2 MolecularWeight: 344.41146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=NC=NC(=C1[N+](=O)[O-])NC2=CC=NC=C2

Isomeric SMILES

CC(C)CN(CC(C)C)C1=NC=NC(=C1[N+](=O)[O-])NC2=CC=NC=C2

InChI

InChI=1S/C17H24N6O2/c1-12(2)9-22(10-13(3)4)17-15(23(24)25)16(19-11-20-17)21-14-5-7-18-8-6-14/h5-8,11-13H,9-10H2,1-4H3,(H,18,19,20,21)