2-[7-(4-fluorophenyl)-7-(4-methylphenyl)sulfanyl-heptyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[7-(4-fluorophenyl)-7-(4-methylphenyl)sulfanyl-heptyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[7-(4-fluorophenyl)-7-(p-tolylsulfanyl)heptyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline CAS Name: 2-[7-(4-fluorophenyl)-7-[(4-methylphenyl)thio]heptyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[7-(4-fluorophenyl)-7-(4-methylphenyl)sulfanylheptyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[7-(4-fluorophenyl)-7-(p-tolylthio)heptyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Formula: C31H38FNO2S MolecularWeight: 507.702323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CCCCCCN2CCC3=CC(=C(C=C3C2)OC)OC)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)SC(CCCCCCN2CCC3=CC(=C(C=C3C2)OC)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C31H38FNO2S/c1-23-9-15-28(16-10-23)36-31(24-11-13-27(32)14-12-24)8-6-4-5-7-18-33-19-17-25-20-29(34-2)30(35-3)21-26(25)22-33/h9-16,20-21,31H,4-8,17-19,22H2,1-3H3