2-methyl-6-(6-methylsulfonylsulfanylhexoxy)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-methyl-6-(6-methylsulfonylsulfanylhexoxy)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-methyl-6-(6-methylsulfonylsulfanylhexoxy)-3,4-dihydro-1H-isoquinoline CAS Name: 2-methyl-6-[6-(methylsulfonylthio)hexoxy]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-methyl-6-(6-methylsulfonylsulfanylhexoxy)-3,4-dihydro-1H-isoquinoline Traditional Name: 6-[6-(mesylthio)hexoxy]-2-methyl-3,4-dihydro-1H-isoquinoline Formula: C17H27NO3S2 MolecularWeight: 357.53118

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)C=CC(=C2)OCCCCCCSS(=O)(=O)C

Isomeric SMILES

CN1CCC2=C(C1)C=CC(=C2)OCCCCCCSS(=O)(=O)C

InChI

InChI=1S/C17H27NO3S2/c1-18-10-9-15-13-17(8-7-16(15)14-18)21-11-5-3-4-6-12-22-23(2,19)20/h7-8,13H,3-6,9-12,14H2,1-2H3