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

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(1-piperidylsulfonyl)-2-thienyl]ethanone CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[5-(1-piperidinylsulfonyl)-2-thiophenyl]ethanone IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-(5-piperidinosulfonyl-2-thienyl)ethanone Formula: C22H28N2O5S2 MolecularWeight: 464.59812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CC3=CC=C(S3)S(=O)(=O)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CC3=CC=C(S3)S(=O)(=O)N4CCCCC4)OC

InChI

InChI=1S/C22H28N2O5S2/c1-28-19-12-16-8-11-23(15-17(16)13-20(19)29-2)21(25)14-18-6-7-22(30-18)31(26,27)24-9-4-3-5-10-24/h6-7,12-13H,3-5,8-11,14-15H2,1-2H3