2,6-bis(fluoranyl)-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide

Systemtic Name: 2,6-bis(fluoranyl)-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2,6-difluoro-benzenesulfonamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2,6-difluorobenzenesulfonamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-2,6-difluorobenzenesulfonamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,6-difluoro-benzenesulfonamide Formula: C21H18F2N2O4S2 MolecularWeight: 464.505426

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NS(=O)(=O)C3=C(C=CC=C3F)F)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NS(=O)(=O)C3=C(C=CC=C3F)F)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H18F2N2O4S2/c22-19-7-4-8-20(23)21(19)30(26,27)24-17-10-9-15-11-12-25(14-16(15)13-17)31(28,29)18-5-2-1-3-6-18/h1-10,13,24H,11-12,14H2