5-bromanyl-2-methoxy-N-[1-(4-methylsulfanylphenyl)-1,3-bis(oxidanyl)propan-2-yl]benzenesulfonamide

Systemtic Name: 5-bromanyl-2-methoxy-N-[1-(4-methylsulfanylphenyl)-1,3-bis(oxidanyl)propan-2-yl]benzenesulfonamide Openeye Name: 5-bromo-N-[2-hydroxy-1-(hydroxymethyl)-2-(4-methylsulfanylphenyl)ethyl]-2-methoxy-benzenesulfonamide CAS Name: 5-bromo-N-[1,3-dihydroxy-1-[4-(methylthio)phenyl]propan-2-yl]-2-methoxybenzenesulfonamide IUPAC Name: 5-bromo-N-[1,3-dihydroxy-1-(4-methylsulfanylphenyl)propan-2-yl]-2-methoxybenzenesulfonamide Traditional Name: 5-bromo-N-[2-hydroxy-1-methylol-2-[4-(methylthio)phenyl]ethyl]-2-methoxy-benzenesulfonamide Formula: C17H20BrNO5S2 MolecularWeight: 462.3784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC(CO)C(C2=CC=C(C=C2)SC)O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NC(CO)C(C2=CC=C(C=C2)SC)O

InChI

InChI=1S/C17H20BrNO5S2/c1-24-15-8-5-12(18)9-16(15)26(22,23)19-14(10-20)17(21)11-3-6-13(25-2)7-4-11/h3-9,14,17,19-21H,10H2,1-2H3