N4-tert-butyl-5-nitro-N6-pyridin-3-yl-pyrimidine-4,6-diamine

Systemtic Name: N4-tert-butyl-5-nitro-N6-pyridin-3-yl-pyrimidine-4,6-diamine Openeye Name: N4-tert-butyl-5-nitro-N6-(3-pyridyl)pyrimidine-4,6-diamine CAS Name: N4-tert-butyl-5-nitro-N6-(3-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-tert-butyl-5-nitro-6-N-pyridin-3-ylpyrimidine-4,6-diamine Traditional Name: tert-butyl-[5-nitro-6-(3-pyridylamino)pyrimidin-4-yl]amine Formula: C13H16N6O2 MolecularWeight: 288.30514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CN=CC=C2

Isomeric SMILES

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CN=CC=C2

InChI

InChI=1S/C13H16N6O2/c1-13(2,3)18-12-10(19(20)21)11(15-8-16-12)17-9-5-4-6-14-7-9/h4-8H,1-3H3,(H2,15,16,17,18)