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OR7

Summary
Name:2-chloro-N-{4-chloro-3-[(2-methoxyethyl)(methyl)sulfamoyl]phenyl}acetamide
Formula:C12 H16 Cl2 N2 O4 S
Formal charge:0
Formula weight:355.237 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-chloro-N-{4-chloro-3-[(2-methoxyethyl)(methyl)sulfamoyl]phenyl}acetamide
OpenEye OEToolkits2.0.72-chloranyl-~{N}-[4-chloranyl-3-[2-methoxyethyl(methyl)sulfamoyl]phenyl]ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(C(Nc1ccc(Cl)c(c1)S(=O)(=O)N(C)CCOC)=O)Cl
InChIInChI1.03InChI=1S/C12H16Cl2N2O4S/c1-16(5-6-20-2)21(18,19)11-7-9(3-4-10(11)14)15-12(17)8-13/h3-4,7H,5-6,8H2,1-2H3,(H,15,17)
InChIKeyInChI1.03ADUIOJAMEFYIGZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385COCCN(C)[S](=O)(=O)c1cc(NC(=O)CCl)ccc1Cl
SMILESCACTVS3.385COCCN(C)[S](=O)(=O)c1cc(NC(=O)CCl)ccc1Cl
SMILES_CANONICALOpenEye OEToolkits2.0.7CN(CCOC)S(=O)(=O)c1cc(ccc1Cl)NC(=O)CCl
SMILESOpenEye OEToolkits2.0.7CN(CCOC)S(=O)(=O)c1cc(ccc1Cl)NC(=O)CCl

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PDB entries from 2024-07-17

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