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

Systemtic Name: 5-nitro-N6-(4-phenoxyphenyl)-N4-quinolin-8-yl-pyrimidine-4,6-diamine Openeye Name: 5-nitro-N6-(4-phenoxyphenyl)-N4-(8-quinolyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N6-(4-phenoxyphenyl)-N4-(8-quinolinyl)pyrimidine-4,6-diamine IUPAC Name: 5-nitro-6-N-(4-phenoxyphenyl)-4-N-quinolin-8-ylpyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(4-phenoxyanilino)pyrimidin-4-yl]-(8-quinolyl)amine Formula: C25H18N6O3 MolecularWeight: 450.44882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C(C(=NC=N3)NC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC3=C(C(=NC=N3)NC4=CC=CC5=C4N=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C25H18N6O3/c32-31(33)23-24(29-18-11-13-20(14-12-18)34-19-8-2-1-3-9-19)27-16-28-25(23)30-21-10-4-6-17-7-5-15-26-22(17)21/h1-16H,(H2,27,28,29,30)