N4-(2-ethylphenyl)-N6-phenethyl-pyrimidine-4,5,6-triamine

Systemtic Name: N4-(2-ethylphenyl)-N6-phenethyl-pyrimidine-4,5,6-triamine Openeye Name: N4-(2-ethylphenyl)-N6-phenethyl-pyrimidine-4,5,6-triamine CAS Name: N4-(2-ethylphenyl)-N6-phenethylpyrimidine-4,5,6-triamine IUPAC Name: 4-N-(2-ethylphenyl)-6-N-phenethylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(2-ethylanilino)pyrimidin-4-yl]-phenethyl-amine Formula: C20H23N5 MolecularWeight: 333.43012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NCCC3=CC=CC=C3)N

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=NC=N2)NCCC3=CC=CC=C3)N

InChI

InChI=1S/C20H23N5/c1-2-16-10-6-7-11-17(16)25-20-18(21)19(23-14-24-20)22-13-12-15-8-4-3-5-9-15/h3-11,14H,2,12-13,21H2,1H3,(H2,22,23,24,25)