N4-cyclopentyl-5-nitro-N6-quinolin-8-yl-pyrimidine-4,6-diamine

Systemtic Name: N4-cyclopentyl-5-nitro-N6-quinolin-8-yl-pyrimidine-4,6-diamine Openeye Name: N4-cyclopentyl-5-nitro-N6-(8-quinolyl)pyrimidine-4,6-diamine CAS Name: N4-cyclopentyl-5-nitro-N6-(8-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-cyclopentyl-5-nitro-6-N-quinolin-8-ylpyrimidine-4,6-diamine Traditional Name: cyclopentyl-[5-nitro-6-(8-quinolylamino)pyrimidin-4-yl]amine Formula: C18H18N6O2 MolecularWeight: 350.37452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

C1CCC(C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C18H18N6O2/c25-24(26)16-17(22-13-7-1-2-8-13)20-11-21-18(16)23-14-9-3-5-12-6-4-10-19-15(12)14/h3-6,9-11,13H,1-2,7-8H2,(H2,20,21,22,23)