3,3,5-trimethyl-1-methylsulfanyl-4H-isoquinoline

Systemtic Name: 3,3,5-trimethyl-1-methylsulfanyl-4H-isoquinoline Openeye Name: 3,3,5-trimethyl-1-methylsulfanyl-4H-isoquinoline CAS Name: 3,3,5-trimethyl-1-(methylthio)-4H-isoquinoline IUPAC Name: 3,3,5-trimethyl-1-methylsulfanyl-4H-isoquinoline Traditional Name: 3,3,5-trimethyl-1-(methylthio)-4H-isoquinoline Formula: C13H17NS MolecularWeight: 219.34578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1CC(N=C2SC)(C)C

Isomeric SMILES

CC1=CC=CC2=C1CC(N=C2SC)(C)C

InChI

InChI=1S/C13H17NS/c1-9-6-5-7-10-11(9)8-13(2,3)14-12(10)15-4/h5-7H,8H2,1-4H3