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

Systemtic Name: 2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidin-1-yl-ethanone Openeye Name: 2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-(1-piperidyl)ethanone CAS Name: 2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-(1-piperidinyl)ethanone IUPAC Name: 2-(6,7-dimethoxy-1-thiophen-2-yl-3,4-dihydro-1H-isoquinolin-2-yl)-1-piperidin-1-ylethanone Traditional Name: 2-[6,7-dimethoxy-1-(2-thienyl)-3,4-dihydro-1H-isoquinolin-2-yl]-1-piperidino-ethanone Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)CC(=O)N3CCCCC3)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)CC(=O)N3CCCCC3)C4=CC=CS4)OC

InChI

InChI=1S/C22H28N2O3S/c1-26-18-13-16-8-11-24(15-21(25)23-9-4-3-5-10-23)22(20-7-6-12-28-20)17(16)14-19(18)27-2/h6-7,12-14,22H,3-5,8-11,15H2,1-2H3