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

Systemtic Name: N4-tert-butyl-5-nitro-N6-quinolin-5-yl-pyrimidine-4,6-diamine Openeye Name: N4-tert-butyl-5-nitro-N6-(5-quinolyl)pyrimidine-4,6-diamine CAS Name: N4-tert-butyl-5-nitro-N6-(5-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-tert-butyl-5-nitro-6-N-quinolin-5-ylpyrimidine-4,6-diamine Traditional Name: tert-butyl-[5-nitro-6-(5-quinolylamino)pyrimidin-4-yl]amine Formula: C17H18N6O2 MolecularWeight: 338.36382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2C=CC=N3

Isomeric SMILES

CC(C)(C)NC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2C=CC=N3

InChI

InChI=1S/C17H18N6O2/c1-17(2,3)22-16-14(23(24)25)15(19-10-20-16)21-13-8-4-7-12-11(13)6-5-9-18-12/h4-10H,1-3H3,(H2,19,20,21,22)