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

Systemtic Name: 5-chloranyl-6-methyl-N-[2-(2-methyl-4-pentyl-phenoxy)ethyl]pyrimidin-4-amine hydrochloride Openeye Name: 5-chloro-6-methyl-N-[2-(2-methyl-4-pentyl-phenoxy)ethyl]pyrimidin-4-amine hydrochloride CAS Name: 5-chloro-6-methyl-N-[2-(2-methyl-4-pentylphenoxy)ethyl]-4-pyrimidinamine hydrochloride IUPAC Name: 5-chloro-6-methyl-N-[2-(2-methyl-4-pentylphenoxy)ethyl]pyrimidin-4-amine hydrochloride Traditional Name: 2-(4-amyl-2-methyl-phenoxy)ethyl-(5-chloro-6-methyl-pyrimidin-4-yl)amine hydrochloride Formula: C19H27Cl2N3O MolecularWeight: 384.34318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OCCNC2=NC=NC(=C2Cl)C)C.Cl

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OCCNC2=NC=NC(=C2Cl)C)C.Cl

InChI

InChI=1S/C19H26ClN3O.ClH/c1-4-5-6-7-16-8-9-17(14(2)12-16)24-11-10-21-19-18(20)15(3)22-13-23-19;/h8-9,12-13H,4-7,10-11H2,1-3H3,(H,21,22,23);1H