5-nitro-N4,N6-bis(phenylmethyl)-N4,N6-dipyridin-2-yl-pyrimidine-4,6-diamine

Systemtic Name: 5-nitro-N4,N6-bis(phenylmethyl)-N4,N6-dipyridin-2-yl-pyrimidine-4,6-diamine Openeye Name: N4,N6-dibenzyl-5-nitro-N4,N6-bis(2-pyridyl)pyrimidine-4,6-diamine CAS Name: 5-nitro-N4,N6-bis(phenylmethyl)-N4,N6-bis(2-pyridinyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,6-N-dibenzyl-5-nitro-4-N,6-N-dipyridin-2-ylpyrimidine-4,6-diamine Traditional Name: benzyl-[6-[benzyl(2-pyridyl)amino]-5-nitro-pyrimidin-4-yl]-(2-pyridyl)amine Formula: C28H23N7O2 MolecularWeight: 489.52792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=C(C(=NC=N3)N(CC4=CC=CC=C4)C5=CC=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=N2)C3=C(C(=NC=N3)N(CC4=CC=CC=C4)C5=CC=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C28H23N7O2/c36-35(37)26-27(33(24-15-7-9-17-29-24)19-22-11-3-1-4-12-22)31-21-32-28(26)34(25-16-8-10-18-30-25)20-23-13-5-2-6-14-23/h1-18,21H,19-20H2