5-[[1-[2-(1-benzofuran-3-yl)ethyl]piperidin-4-yl]methyl-methyl-sulfamoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide

Systemtic Name: 5-[[1-[2-(1-benzofuran-3-yl)ethyl]piperidin-4-yl]methyl-methyl-sulfamoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: 5-[[1-[2-(benzofuran-3-yl)ethyl]-4-piperidyl]methyl-methyl-sulfamoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: 5-[[1-[2-(3-benzofuranyl)ethyl]-4-piperidinyl]methyl-methylsulfamoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: 5-[[1-[2-(1-benzofuran-3-yl)ethyl]piperidin-4-yl]methyl-methylsulfamoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: 5-[[1-[2-(benzofuran-3-yl)ethyl]-4-piperidyl]methyl-methyl-sulfamoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C28H36N4O4S MolecularWeight: 524.67484

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N1CCC2=C(C1)C=CC=C2S(=O)(=O)N(C)CC3CCN(CC3)CCC4=COC5=CC=CC=C54

Isomeric SMILES

CNC(=O)N1CCC2=C(C1)C=CC=C2S(=O)(=O)N(C)CC3CCN(CC3)CCC4=COC5=CC=CC=C54

InChI

InChI=1S/C28H36N4O4S/c1-29-28(33)32-17-13-25-22(19-32)6-5-9-27(25)37(34,35)30(2)18-21-10-14-31(15-11-21)16-12-23-20-36-26-8-4-3-7-24(23)26/h3-9,20-21H,10-19H2,1-2H3,(H,29,33)