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1-(1-methylsulfanyl-5,6,7,8-tetrahydroisoquinolin-3-yl)butan-1-one

1-(1-methylsulfanyl-5,6,7,8-tetrahydroisoquinolin-3-yl)butan-1-one

Systemtic Name:1-(1-methylsulfanyl-5,6,7,8-tetrahydroisoquinolin-3-yl)butan-1-one
Openeye Name:1-(1-methylsulfanyl-5,6,7,8-tetrahydroisoquinolin-3-yl)butan-1-one
CAS Name:1-[1-(methylthio)-5,6,7,8-tetrahydroisoquinolin-3-yl]-1-butanone
IUPAC Name:1-(1-methylsulfanyl-5,6,7,8-tetrahydroisoquinolin-3-yl)butan-1-one
Traditional Name:1-[1-(methylthio)-5,6,7,8-tetrahydroisoquinolin-3-yl]butan-1-one
Formula: C14H19NOS
MolecularWeight: 249.37176
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=NC(=C2CCCCC2=C1)SC


Isomeric SMILES

CCCC(=O)C1=NC(=C2CCCCC2=C1)SC


InChI

InChI=1S/C14H19NOS/c1-3-6-13(16)12-9-10-7-4-5-8-11(10)14(15-12)17-2/h9H,3-8H2,1-2H3


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