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

Systemtic Name: N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-4-fluoranyl-N-phenyl-benzenesulfonamide Openeye Name: N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-4-fluoro-N-phenyl-benzenesulfonamide CAS Name: N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-fluoro-N-phenylbenzenesulfonamide IUPAC Name: N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-4-fluoro-N-phenylbenzenesulfonamide Traditional Name: N-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-4-fluoro-N-phenyl-benzenesulfonamide Formula: C25H25FN2O5S MolecularWeight: 484.539803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CN(C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CN(C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C25H25FN2O5S/c1-32-23-14-18-12-13-27(16-19(18)15-24(23)33-2)25(29)17-28(21-6-4-3-5-7-21)34(30,31)22-10-8-20(26)9-11-22/h3-11,14-15H,12-13,16-17H2,1-2H3