2-bromanyl-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4,5-dimethoxy-benzenesulfonamide

Systemtic Name: 2-bromanyl-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4,5-dimethoxy-benzenesulfonamide Openeye Name: 2-bromo-4,5-dimethoxy-N-[(4S)-thiochroman-4-yl]benzenesulfonamide CAS Name: 2-bromo-N-[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]-4,5-dimethoxybenzenesulfonamide IUPAC Name: 2-bromo-N-[(4S)-3,4-dihydro-2H-thiochromen-4-yl]-4,5-dimethoxybenzenesulfonamide Traditional Name: 2-bromo-4,5-dimethoxy-N-[(4S)-thiochroman-4-yl]benzenesulfonamide Formula: C17H18BrNO4S2 MolecularWeight: 444.36312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)NC2CCSC3=CC=CC=C23

Isomeric SMILES

COC1=CC(=C(C=C1OC)Br)S(=O)(=O)N[C@H]2CCSC3=CC=CC=C23

InChI

InChI=1S/C17H18BrNO4S2/c1-22-14-9-12(18)17(10-15(14)23-2)25(20,21)19-13-7-8-24-16-6-4-3-5-11(13)16/h3-6,9-10,13,19H,7-8H2,1-2H3/t13-/m0/s1