2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-indan-5-ylsulfanyl-ethanone CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethanone Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(indan-5-ylthio)ethanone Formula: C22H25NO3S MolecularWeight: 383.5038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CSC3=CC4=C(CCC4)C=C3)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CSC3=CC4=C(CCC4)C=C3)OC

InChI

InChI=1S/C22H25NO3S/c1-25-20-11-17-8-9-23(13-18(17)12-21(20)26-2)22(24)14-27-19-7-6-15-4-3-5-16(15)10-19/h6-7,10-12H,3-5,8-9,13-14H2,1-2H3