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

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide Openeye Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-thienylmethyl)benzenesulfonamide CAS Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-(thiophen-2-ylmethyl)benzenesulfonamide IUPAC Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide Traditional Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-thenyl)benzenesulfonamide Formula: C21H20N2O3S2 MolecularWeight: 412.5251

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CS4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H20N2O3S2/c24-21(23-11-10-16-5-1-2-6-18(16)15-23)17-7-3-9-20(13-17)28(25,26)22-14-19-8-4-12-27-19/h1-9,12-13,22H,10-11,14-15H2