1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[(2-methylsulfanylethylamino)methyl]phenoxy]propan-2-ol

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[(2-methylsulfanylethylamino)methyl]phenoxy]propan-2-ol Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[(2-methylsulfanylethylamino)methyl]phenoxy]propan-2-ol CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[[2-(methylthio)ethylamino]methyl]phenoxy]-2-propanol IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[(2-methylsulfanylethylamino)methyl]phenoxy]propan-2-ol Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[3-[[2-(methylthio)ethylamino]methyl]phenoxy]propan-2-ol Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CSCCNCC1=CC(=CC=C1)OCC(CN2CCC3=CC=CC=C3C2)O

Isomeric SMILES

CSCCNCC1=CC(=CC=C1)OCC(CN2CCC3=CC=CC=C3C2)O

InChI

InChI=1S/C22H30N2O2S/c1-27-12-10-23-14-18-5-4-8-22(13-18)26-17-21(25)16-24-11-9-19-6-2-3-7-20(19)15-24/h2-8,13,21,23,25H,9-12,14-17H2,1H3