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2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(2-hydroxyethylsulfanyl)ethanenitrile

2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(2-hydroxyethylsulfanyl)ethanenitrile

Systemtic Name:2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(2-hydroxyethylsulfanyl)ethanenitrile
Openeye Name:2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(2-hydroxyethylsulfanyl)acetonitrile
CAS Name:2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(2-hydroxyethylthio)acetonitrile
IUPAC Name:2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(2-hydroxyethylsulfanyl)acetonitrile
Traditional Name:2-(6,7-dimethoxy-3,4-dihydroisoquinolin-1-yl)-2-(2-hydroxyethylthio)acetonitrile
Formula: C15H18N2O3S
MolecularWeight: 306.38002
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)CCN=C2C(C#N)SCCO)OC


Isomeric SMILES

COC1=C(C=C2C(=C1)CCN=C2C(C#N)SCCO)OC


InChI

InChI=1S/C15H18N2O3S/c1-19-12-7-10-3-4-17-15(11(10)8-13(12)20-2)14(9-16)21-6-5-18/h7-8,14,18H,3-6H2,1-2H3


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