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2-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]aniline

2-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]aniline

Systemtic Name:2-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]aniline
Openeye Name:2-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]aniline
CAS Name:2-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylthio]aniline
IUPAC Name:2-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylsulfanyl]aniline
Traditional Name:[2-[3-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)propylthio]phenyl]amine
Formula: C20H26N2O2S
MolecularWeight: 358.49764
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)CCCSC3=CC=CC=C3N)OC


Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)CCCSC3=CC=CC=C3N)OC


InChI

InChI=1S/C20H26N2O2S/c1-23-18-12-15-8-10-22(14-16(15)13-19(18)24-2)9-5-11-25-20-7-4-3-6-17(20)21/h3-4,6-7,12-13H,5,8-11,14,21H2,1-2H3


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