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

Systemtic Name: N6-methyl-5-nitro-N4-quinolin-8-yl-pyrimidine-4,6-diamine Openeye Name: N6-methyl-5-nitro-N4-(8-quinolyl)pyrimidine-4,6-diamine CAS Name: N6-methyl-5-nitro-N4-(8-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-methyl-5-nitro-4-N-quinolin-8-ylpyrimidine-4,6-diamine Traditional Name: methyl-[5-nitro-6-(8-quinolylamino)pyrimidin-4-yl]amine Formula: C14H12N6O2 MolecularWeight: 296.28408

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CNC1=NC=NC(=C1[N+](=O)[O-])NC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C14H12N6O2/c1-15-13-12(20(21)22)14(18-8-17-13)19-10-6-2-4-9-5-3-7-16-11(9)10/h2-8H,1H3,(H2,15,17,18,19)