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Q1J

Summary
Name:5-bromo-N-(4-hydroxy[1,1'-biphenyl]-3-yl)-2-methoxybenzene-1-sulfonamide
Formula:C19 H16 Br N O4 S
Formal charge:0
Formula weight:434.304 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.015-bromo-N-(4-hydroxy[1,1'-biphenyl]-3-yl)-2-methoxybenzene-1-sulfonamide
OpenEye OEToolkits2.0.75-bromanyl-2-methoxy-~{N}-(2-oxidanyl-5-phenyl-phenyl)benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1(ccc(c(c1)S(Nc3c(ccc(c2ccccc2)c3)O)(=O)=O)OC)Br
InChIInChI1.03InChI=1S/C19H16BrNO4S/c1-25-18-10-8-15(20)12-19(18)26(23,24)21-16-11-14(7-9-17(16)22)13-5-3-2-4-6-13/h2-12,21-22H,1H3
InChIKeyInChI1.03LSOYIZUYLCYRNG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc(Br)cc1[S](=O)(=O)Nc2cc(ccc2O)c3ccccc3
SMILESCACTVS3.385COc1ccc(Br)cc1[S](=O)(=O)Nc2cc(ccc2O)c3ccccc3
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1ccc(cc1S(=O)(=O)Nc2cc(ccc2O)c3ccccc3)Br
SMILESOpenEye OEToolkits2.0.7COc1ccc(cc1S(=O)(=O)Nc2cc(ccc2O)c3ccccc3)Br

217705

PDB entries from 2024-03-27

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