3,3-diethyl-1-methylsulfanyl-4H-isoquinoline

Systemtic Name: 3,3-diethyl-1-methylsulfanyl-4H-isoquinoline Openeye Name: 3,3-diethyl-1-methylsulfanyl-4H-isoquinoline CAS Name: 3,3-diethyl-1-(methylthio)-4H-isoquinoline IUPAC Name: 3,3-diethyl-1-methylsulfanyl-4H-isoquinoline Traditional Name: 3,3-diethyl-1-(methylthio)-4H-isoquinoline Formula: C14H19NS MolecularWeight: 233.37236

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C(=N1)SC)CC

Isomeric SMILES

CCC1(CC2=CC=CC=C2C(=N1)SC)CC

InChI

InChI=1S/C14H19NS/c1-4-14(5-2)10-11-8-6-7-9-12(11)13(15-14)16-3/h6-9H,4-5,10H2,1-3H3