O-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)methyl] N-methylcarbamothioate

Systemtic Name: O-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)methyl] N-methylcarbamothioate Openeye Name: O-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)methyl] N-methylcarbamothioate CAS Name: N-methylcarbamothioic acid O-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)methyl] ester IUPAC Name: O-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)methyl] N-methylcarbamothioate Traditional Name: N-methylthiocarbamic acid O-[(6,7-dimethoxy-2-methyl-3,4-dihydro-1H-isoquinolin-3-yl)methyl] ester Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)OCC1CC2=CC(=C(C=C2CN1C)OC)OC

Isomeric SMILES

CNC(=S)OCC1CC2=CC(=C(C=C2CN1C)OC)OC

InChI

InChI=1S/C15H22N2O3S/c1-16-15(21)20-9-12-5-10-6-13(18-3)14(19-4)7-11(10)8-17(12)2/h6-7,12H,5,8-9H2,1-4H3,(H,16,21)