N-[2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]-4-fluoranyl-benzenesulfonamide

Systemtic Name: N-[2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]phenyl]-4-fluoranyl-benzenesulfonamide Openeye Name: N-[2-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-4-fluoro-benzenesulfonamide CAS Name: N-[2-[(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]phenyl]-4-fluorobenzenesulfonamide IUPAC Name: N-[2-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-4-fluorobenzenesulfonamide Traditional Name: N-[2-(6,7-diethoxy-3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-4-fluoro-benzenesulfonamide Formula: C26H27FN2O5S MolecularWeight: 498.566383

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)F)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC=C(C=C4)F)OCC

InChI

InChI=1S/C26H27FN2O5S/c1-3-33-24-15-18-13-14-29(17-19(18)16-25(24)34-4-2)26(30)22-7-5-6-8-23(22)28-35(31,32)21-11-9-20(27)10-12-21/h5-12,15-16,28H,3-4,13-14,17H2,1-2H3