N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-1-phenyl-ethyl]piazthiole-4-sulfonamide Formula: C23H20N4O3S2 MolecularWeight: 464.5599

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N4O3S2/c28-23(27-14-13-16-7-4-5-10-18(16)15-27)21(17-8-2-1-3-9-17)26-32(29,30)20-12-6-11-19-22(20)25-31-24-19/h1-12,21,26H,13-15H2