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

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)sulfanyl-butyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-(3,4-dimethoxyphenyl)-4-(p-tolylsulfanyl)butyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-(3,4-dimethoxyphenyl)-4-[(4-methylphenyl)thio]butyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)-4-(4-methylphenyl)sulfanylbutyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-(3,4-dimethoxyphenyl)-4-(p-tolylthio)butyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Formula: C30H37NO4S MolecularWeight: 507.68408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(CCCN2CCC3=CC(=C(C=C3C2)OC)OC)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)SC(CCCN2CCC3=CC(=C(C=C3C2)OC)OC)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C30H37NO4S/c1-21-8-11-25(12-9-21)36-30(23-10-13-26(32-2)27(18-23)33-3)7-6-15-31-16-14-22-17-28(34-4)29(35-5)19-24(22)20-31/h8-13,17-19,30H,6-7,14-16,20H2,1-5H3