5-nitro-N6-pyridin-3-yl-N4-quinolin-8-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N6-pyridin-3-yl-N4-quinolin-8-yl-pyrimidine-4,6-diamine Openeye Name: 5-nitro-N6-(3-pyridyl)-N4-(8-quinolyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N6-(3-pyridinyl)-N4-(8-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-6-N-pyridin-3-yl-4-N-quinolin-8-ylpyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(3-pyridylamino)pyrimidin-4-yl]-(8-quinolyl)amine Formula: C18H13N7O2 MolecularWeight: 359.34152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CN=CC=C4)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)NC3=NC=NC(=C3[N+](=O)[O-])NC4=CN=CC=C4)N=CC=C2

InChI

InChI=1S/C18H13N7O2/c26-25(27)16-17(23-13-6-3-8-19-10-13)21-11-22-18(16)24-14-7-1-4-12-5-2-9-20-15(12)14/h1-11H,(H2,21,22,23,24)