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

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

CC1=CC=C(C=C1)SCCCCCCC2C3=CC(=C(C=C3CCN2)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCCCCCCC2C3=CC(=C(C=C3CCN2)OC)OC

InChI

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