N4-ethyl-N4-naphthalen-1-yl-5-nitro-N6-pyridin-4-yl-pyrimidine-4,6-diamine

Systemtic Name: N4-ethyl-N4-naphthalen-1-yl-5-nitro-N6-pyridin-4-yl-pyrimidine-4,6-diamine Openeye Name: N4-ethyl-N4-(1-naphthyl)-5-nitro-N6-(4-pyridyl)pyrimidine-4,6-diamine CAS Name: N4-ethyl-N4-(1-naphthalenyl)-5-nitro-N6-pyridin-4-ylpyrimidine-4,6-diamine IUPAC Name: 4-N-ethyl-4-N-naphthalen-1-yl-5-nitro-6-N-pyridin-4-ylpyrimidine-4,6-diamine Traditional Name: ethyl-(1-naphthyl)-[5-nitro-6-(4-pyridylamino)pyrimidin-4-yl]amine Formula: C21H18N6O2 MolecularWeight: 386.40662

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=CC=CC=C21)C3=NC=NC(=C3[N+](=O)[O-])NC4=CC=NC=C4

Isomeric SMILES

CCN(C1=CC=CC2=CC=CC=C21)C3=NC=NC(=C3[N+](=O)[O-])NC4=CC=NC=C4

InChI

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