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

Systemtic Name: N6-naphthalen-1-yl-5-nitro-N4-(1-phenylethyl)pyrimidine-4,6-diamine Openeye Name: N6-(1-naphthyl)-5-nitro-N4-(1-phenylethyl)pyrimidine-4,6-diamine CAS Name: N6-(1-naphthalenyl)-5-nitro-N4-(1-phenylethyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-naphthalen-1-yl-5-nitro-4-N-(1-phenylethyl)pyrimidine-4,6-diamine Traditional Name: 1-naphthyl-[5-nitro-6-(1-phenylethylamino)pyrimidin-4-yl]amine Formula: C22H19N5O2 MolecularWeight: 385.41856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC(=C2[N+](=O)[O-])NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H19N5O2/c1-15(16-8-3-2-4-9-16)25-21-20(27(28)29)22(24-14-23-21)26-19-13-7-11-17-10-5-6-12-18(17)19/h2-15H,1H3,(H2,23,24,25,26)