N-[5-chloranyl-2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[5-chloranyl-2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[5-chloro-2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[5-chloro-2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[5-chloro-2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[5-chloro-2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]piazthiole-4-sulfonamide Formula: C22H17ClN4O3S2 MolecularWeight: 484.97838

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C3=C(C=C(C=C3)Cl)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C3=C(C=C(C=C3)Cl)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C22H17ClN4O3S2/c23-16-8-9-17(22(28)27-11-10-14-4-1-2-5-15(14)13-27)19(12-16)26-32(29,30)20-7-3-6-18-21(20)25-31-24-18/h1-9,12,26H,10-11,13H2