N4-(4-methylphenyl)-5-nitro-N6-phenethyl-pyrimidine-4,6-diamine

Systemtic Name: N4-(4-methylphenyl)-5-nitro-N6-phenethyl-pyrimidine-4,6-diamine Openeye Name: 5-nitro-N6-phenethyl-N4-(p-tolyl)pyrimidine-4,6-diamine CAS Name: N4-(4-methylphenyl)-5-nitro-N6-phenethylpyrimidine-4,6-diamine IUPAC Name: 4-N-(4-methylphenyl)-5-nitro-6-N-phenethylpyrimidine-4,6-diamine Traditional Name: [5-nitro-6-(phenethylamino)pyrimidin-4-yl]-(p-tolyl)amine Formula: C19H19N5O2 MolecularWeight: 349.38646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=NC=N2)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O2/c1-14-7-9-16(10-8-14)23-19-17(24(25)26)18(21-13-22-19)20-12-11-15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H2,20,21,22,23)