N6-naphthalen-1-yl-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine

Systemtic Name: N6-naphthalen-1-yl-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine Openeye Name: N4,N4-dibenzyl-N6-(1-naphthyl)-5-nitro-pyrimidine-4,6-diamine CAS Name: N6-(1-naphthalenyl)-5-nitro-N4,N4-bis(phenylmethyl)pyrimidine-4,6-diamine IUPAC Name: 4-N,4-N-dibenzyl-6-N-naphthalen-1-yl-5-nitropyrimidine-4,6-diamine Traditional Name: dibenzyl-[6-(1-naphthylamino)-5-nitro-pyrimidin-4-yl]amine Formula: C28H23N5O2 MolecularWeight: 461.51452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CN(CC2=CC=CC=C2)C3=NC=NC(=C3[N+](=O)[O-])NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C28H23N5O2/c34-33(35)26-27(31-25-17-9-15-23-14-7-8-16-24(23)25)29-20-30-28(26)32(18-21-10-3-1-4-11-21)19-22-12-5-2-6-13-22/h1-17,20H,18-19H2,(H,29,30,31)