5-butyl-6-methyl-N-[2-(2-methyl-4-pentyl-phenoxy)ethyl]pyrimidin-4-amine

Systemtic Name: 5-butyl-6-methyl-N-[2-(2-methyl-4-pentyl-phenoxy)ethyl]pyrimidin-4-amine Openeye Name: 5-butyl-6-methyl-N-[2-(2-methyl-4-pentyl-phenoxy)ethyl]pyrimidin-4-amine CAS Name: 5-butyl-6-methyl-N-[2-(2-methyl-4-pentylphenoxy)ethyl]-4-pyrimidinamine IUPAC Name: 5-butyl-6-methyl-N-[2-(2-methyl-4-pentylphenoxy)ethyl]pyrimidin-4-amine Traditional Name: 2-(4-amyl-2-methyl-phenoxy)ethyl-(5-butyl-6-methyl-pyrimidin-4-yl)amine Formula: C23H35N3O MolecularWeight: 369.5435

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OCCNC2=NC=NC(=C2CCCC)C)C

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OCCNC2=NC=NC(=C2CCCC)C)C

InChI

InChI=1S/C23H35N3O/c1-5-7-9-10-20-12-13-22(18(3)16-20)27-15-14-24-23-21(11-8-6-2)19(4)25-17-26-23/h12-13,16-17H,5-11,14-15H2,1-4H3,(H,24,25,26)