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

Systemtic Name: N4-ethyl-5-nitro-N4-phenyl-N6-quinolin-8-yl-pyrimidine-4,6-diamine Openeye Name: N4-ethyl-5-nitro-N4-phenyl-N6-(8-quinolyl)pyrimidine-4,6-diamine CAS Name: N4-ethyl-5-nitro-N4-phenyl-N6-(8-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N-ethyl-5-nitro-4-N-phenyl-6-N-quinolin-8-ylpyrimidine-4,6-diamine Traditional Name: ethyl-[5-nitro-6-(8-quinolylamino)pyrimidin-4-yl]-phenyl-amine Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N6O2/c1-2-26(16-10-4-3-5-11-16)21-19(27(28)29)20(23-14-24-21)25-17-12-6-8-15-9-7-13-22-18(15)17/h3-14H,2H2,1H3,(H,23,24,25)