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Q0Y

Summary
Name:5-bromo-N-(5-chloro-2-hydroxyphenyl)-2-methoxybenzene-1-sulfonamide
Formula:C13 H11 Br Cl N O4 S
Formal charge:0
Formula weight:392.653 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.015-bromo-N-(5-chloro-2-hydroxyphenyl)-2-methoxybenzene-1-sulfonamide
OpenEye OEToolkits2.0.75-bromanyl-~{N}-(5-chloranyl-2-oxidanyl-phenyl)-2-methoxy-benzenesulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1c(Br)ccc(c1S(Nc2cc(ccc2O)Cl)(=O)=O)OC
InChIInChI1.03InChI=1S/C13H11BrClNO4S/c1-20-12-5-2-8(14)6-13(12)21(18,19)16-10-7-9(15)3-4-11(10)17/h2-7,16-17H,1H3
InChIKeyInChI1.03UQWYDZCIYINORK-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COc1ccc(Br)cc1[S](=O)(=O)Nc2cc(Cl)ccc2O
SMILESCACTVS3.385COc1ccc(Br)cc1[S](=O)(=O)Nc2cc(Cl)ccc2O
SMILES_CANONICALOpenEye OEToolkits2.0.7COc1ccc(cc1S(=O)(=O)Nc2cc(ccc2O)Cl)Br
SMILESOpenEye OEToolkits2.0.7COc1ccc(cc1S(=O)(=O)Nc2cc(ccc2O)Cl)Br

218500

PDB entries from 2024-04-17

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