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

Systemtic Name: 5-fluoranyl-2-methoxy-N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]benzenesulfonamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-fluoro-2-methoxy-benzenesulfonamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-fluoro-2-methoxybenzenesulfonamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-5-fluoro-2-methoxybenzenesulfonamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-5-fluoro-2-methoxy-benzenesulfonamide Formula: C22H21FN2O5S2 MolecularWeight: 476.540943

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)S(=O)(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

Isomeric SMILES

COC1=C(C=C(C=C1)F)S(=O)(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=CC=C4)C=C2

InChI

InChI=1S/C22H21FN2O5S2/c1-30-21-10-8-18(23)14-22(21)31(26,27)24-19-9-7-16-11-12-25(15-17(16)13-19)32(28,29)20-5-3-2-4-6-20/h2-10,13-14,24H,11-12,15H2,1H3