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

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide Openeye Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(2-thienylmethyl)benzenesulfonamide CAS Name: 4-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-N-(thiophen-2-ylmethyl)benzenesulfonamide IUPAC Name: 4-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-N-(thiophen-2-ylmethyl)benzenesulfonamide Traditional Name: 4-(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=C(C=C3)S(=O)(=O)NCC4=CC=CS4

Isomeric SMILES

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

InChI

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