N6-butyl-N4-ethyl-N4-phenyl-pyrimidine-4,5,6-triamine

Systemtic Name: N6-butyl-N4-ethyl-N4-phenyl-pyrimidine-4,5,6-triamine Openeye Name: N6-butyl-N4-ethyl-N4-phenyl-pyrimidine-4,5,6-triamine CAS Name: N6-butyl-N4-ethyl-N4-phenylpyrimidine-4,5,6-triamine IUPAC Name: 6-N-butyl-4-N-ethyl-4-N-phenylpyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(butylamino)pyrimidin-4-yl]-ethyl-phenyl-amine Formula: C16H23N5 MolecularWeight: 285.38732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=NC=N1)N(CC)C2=CC=CC=C2)N

Isomeric SMILES

CCCCNC1=C(C(=NC=N1)N(CC)C2=CC=CC=C2)N

InChI

InChI=1S/C16H23N5/c1-3-5-11-18-15-14(17)16(20-12-19-15)21(4-2)13-9-7-6-8-10-13/h6-10,12H,3-5,11,17H2,1-2H3,(H,18,19,20)