6-chloranyl-5-ethyl-N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-5-ethyl-N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]pyrimidin-4-amine Openeye Name: 6-chloro-5-ethyl-N-[2-(4-heptyl-2-methyl-phenoxy)ethyl]pyrimidin-4-amine CAS Name: 6-chloro-5-ethyl-N-[2-(4-heptyl-2-methylphenoxy)ethyl]-4-pyrimidinamine IUPAC Name: 6-chloro-5-ethyl-N-[2-(4-heptyl-2-methylphenoxy)ethyl]pyrimidin-4-amine Traditional Name: (6-chloro-5-ethyl-pyrimidin-4-yl)-[2-(4-heptyl-2-methyl-phenoxy)ethyl]amine Formula: C22H32ClN3O MolecularWeight: 389.96198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC(=C(C=C1)OCCNC2=C(C(=NC=N2)Cl)CC)C

Isomeric SMILES

CCCCCCCC1=CC(=C(C=C1)OCCNC2=C(C(=NC=N2)Cl)CC)C

InChI

InChI=1S/C22H32ClN3O/c1-4-6-7-8-9-10-18-11-12-20(17(3)15-18)27-14-13-24-22-19(5-2)21(23)25-16-26-22/h11-12,15-16H,4-10,13-14H2,1-3H3,(H,24,25,26)