6-bromanyl-5-methoxy-3,3-dimethyl-1-methylsulfanyl-4H-isoquinoline

Systemtic Name: 6-bromanyl-5-methoxy-3,3-dimethyl-1-methylsulfanyl-4H-isoquinoline Openeye Name: 6-bromo-5-methoxy-3,3-dimethyl-1-methylsulfanyl-4H-isoquinoline CAS Name: 6-bromo-5-methoxy-3,3-dimethyl-1-(methylthio)-4H-isoquinoline IUPAC Name: 6-bromo-5-methoxy-3,3-dimethyl-1-methylsulfanyl-4H-isoquinoline Traditional Name: 6-bromo-5-methoxy-3,3-dimethyl-1-(methylthio)-4H-isoquinoline Formula: C13H16BrNOS MolecularWeight: 314.24124

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2OC)Br)C(=N1)SC)C

Isomeric SMILES

CC1(CC2=C(C=CC(=C2OC)Br)C(=N1)SC)C

InChI

InChI=1S/C13H16BrNOS/c1-13(2)7-9-8(12(15-13)17-4)5-6-10(14)11(9)16-3/h5-6H,7H2,1-4H3