5-nitro-N4,N6-di(quinolin-8-yl)pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4,N6-di(quinolin-8-yl)pyrimidine-4,6-diamine Openeye Name: 5-nitro-N4,N6-bis(8-quinolyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4,N6-bis(8-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-4-N,6-N-di(quinolin-8-yl)pyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(8-quinolylamino)pyrimidin-4-yl]-(8-quinolyl)amine Formula: C22H15N7O2 MolecularWeight: 409.4002

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC3=C(C(=NC=N3)NC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-])N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)NC3=C(C(=NC=N3)NC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-])N=CC=C2

InChI

InChI=1S/C22H15N7O2/c30-29(31)20-21(27-16-9-1-5-14-7-3-11-23-18(14)16)25-13-26-22(20)28-17-10-2-6-15-8-4-12-24-19(15)17/h1-13H,(H2,25,26,27,28)