6,7-dimethoxy-1-[1-(4-methylphenyl)sulfanylhexyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 6,7-dimethoxy-1-[1-(4-methylphenyl)sulfanylhexyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 6,7-dimethoxy-1-[1-(p-tolylsulfanyl)hexyl]-1,2,3,4-tetrahydroisoquinoline CAS Name: 6,7-dimethoxy-1-[1-[(4-methylphenyl)thio]hexyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 6,7-dimethoxy-1-[1-(4-methylphenyl)sulfanylhexyl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: 6,7-dimethoxy-1-[1-(p-tolylthio)hexyl]-1,2,3,4-tetrahydroisoquinoline Formula: C24H33NO2S MolecularWeight: 399.58932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C1C2=CC(=C(C=C2CCN1)OC)OC)SC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCC(C1C2=CC(=C(C=C2CCN1)OC)OC)SC3=CC=C(C=C3)C

InChI

InChI=1S/C24H33NO2S/c1-5-6-7-8-23(28-19-11-9-17(2)10-12-19)24-20-16-22(27-4)21(26-3)15-18(20)13-14-25-24/h9-12,15-16,23-25H,5-8,13-14H2,1-4H3