2-[6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)hexyl]sulfanyl-4-methyl-phenol

Systemtic Name: 2-[6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)hexyl]sulfanyl-4-methyl-phenol Openeye Name: 2-[6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)hexyl]sulfanyl-4-methyl-phenol CAS Name: 2-[[6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)hexyl]thio]-4-methylphenol IUPAC Name: 2-[6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)hexyl]sulfanyl-4-methylphenol Traditional Name: 2-[[6-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-1-(3,4-dimethoxyphenyl)hexyl]thio]-4-methyl-phenol Formula: C32H41NO5S MolecularWeight: 551.73664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)SC(CCCCCN2CCC3=CC(=C(C=C3C2)OC)OC)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1)O)SC(CCCCCN2CCC3=CC(=C(C=C3C2)OC)OC)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C32H41NO5S/c1-22-10-12-26(34)32(17-22)39-31(24-11-13-27(35-2)28(19-24)36-3)9-7-6-8-15-33-16-14-23-18-29(37-4)30(38-5)20-25(23)21-33/h10-13,17-20,31,34H,6-9,14-16,21H2,1-5H3