2-[6-(3,4-dimethoxyphenyl)-6-(phenylmethylsulfanyl)hexyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[6-(3,4-dimethoxyphenyl)-6-(phenylmethylsulfanyl)hexyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[6-benzylsulfanyl-6-(3,4-dimethoxyphenyl)hexyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline CAS Name: 2-[6-(3,4-dimethoxyphenyl)-6-(phenylmethylthio)hexyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[6-benzylsulfanyl-6-(3,4-dimethoxyphenyl)hexyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[6-(benzylthio)-6-(3,4-dimethoxyphenyl)hexyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinoline Formula: C32H41NO4S MolecularWeight: 535.73724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CCCCCN2CCC3=CC(=C(C=C3C2)OC)OC)SCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(CCCCCN2CCC3=CC(=C(C=C3C2)OC)OC)SCC4=CC=CC=C4)OC

InChI

InChI=1S/C32H41NO4S/c1-34-28-15-14-26(20-29(28)35-2)32(38-23-24-11-7-5-8-12-24)13-9-6-10-17-33-18-16-25-19-30(36-3)31(37-4)21-27(25)22-33/h5,7-8,11-12,14-15,19-21,32H,6,9-10,13,16-18,22-23H2,1-4H3