4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide Openeye Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-[2-(2-thienyl)ethyl]benzenesulfonamide CAS Name: 4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-(2-thiophen-2-ylethyl)benzenesulfonamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide Traditional Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-[2-(2-thienyl)ethyl]benzenesulfonamide Formula: C22H22N2O3S2 MolecularWeight: 426.55168

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC4=CC=CS4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCCC4=CC=CS4

InChI

InChI=1S/C22H22N2O3S2/c25-22(24-14-12-17-4-1-2-5-19(17)16-24)18-7-9-21(10-8-18)29(26,27)23-13-11-20-6-3-15-28-20/h1-10,15,23H,11-14,16H2