3-[[6-methoxy-1-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy]-N,N-dimethyl-propan-1-amine

Systemtic Name: 3-[[6-methoxy-1-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy]-N,N-dimethyl-propan-1-amine Openeye Name: 3-[[6-methoxy-1-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy]-N,N-dimethyl-propan-1-amine CAS Name: 3-[[6-methoxy-1-[4-(methylthio)phenyl]-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy]-N,N-dimethyl-1-propanamine IUPAC Name: 3-[[6-methoxy-1-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy]-N,N-dimethylpropan-1-amine Traditional Name: 3-[[6-methoxy-1-[4-(methylthio)phenyl]-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy]propyl-dimethyl-amine Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=C(C=C2CCNC(C2=C1)C3=CC=C(C=C3)SC)OC

Isomeric SMILES

CN(C)CCCOC1=C(C=C2CCNC(C2=C1)C3=CC=C(C=C3)SC)OC

InChI

InChI=1S/C22H30N2O2S/c1-24(2)12-5-13-26-21-15-19-17(14-20(21)25-3)10-11-23-22(19)16-6-8-18(27-4)9-7-16/h6-9,14-15,22-23H,5,10-13H2,1-4H3