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

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(2-thienylsulfonyl)-4-piperidyl]methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(1-thiophen-2-ylsulfonylpiperidin-4-yl)methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(2-thienylsulfonyl)-4-piperidyl]methanone Formula: C21H26N2O5S2 MolecularWeight: 450.57154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4)OC

InChI

InChI=1S/C21H26N2O5S2/c1-27-18-12-16-5-8-22(14-17(16)13-19(18)28-2)21(24)15-6-9-23(10-7-15)30(25,26)20-4-3-11-29-20/h3-4,11-13,15H,5-10,14H2,1-2H3