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XX0

Summary
Name:2-chloro-N-{4-chloro-3-[(morpholin-4-yl)sulfonyl]phenyl}acetamide
Formula:C12 H14 Cl2 N2 O4 S
Formal charge:0
Formula weight:353.222 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-chloro-N-{4-chloro-3-[(morpholin-4-yl)sulfonyl]phenyl}acetamide
OpenEye OEToolkits2.0.72-chloranyl-~{N}-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)ethanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C(C(=O)Nc1ccc(Cl)c(c1)S(=O)(=O)N2CCOCC2)Cl
InChIInChI1.03InChI=1S/C12H14Cl2N2O4S/c13-8-12(17)15-9-1-2-10(14)11(7-9)21(18,19)16-3-5-20-6-4-16/h1-2,7H,3-6,8H2,(H,15,17)
InChIKeyInChI1.03DGQBLXIZLVFBCI-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385ClCC(=O)Nc1ccc(Cl)c(c1)[S](=O)(=O)N2CCOCC2
SMILESCACTVS3.385ClCC(=O)Nc1ccc(Cl)c(c1)[S](=O)(=O)N2CCOCC2
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(c(cc1NC(=O)CCl)S(=O)(=O)N2CCOCC2)Cl
SMILESOpenEye OEToolkits2.0.7c1cc(c(cc1NC(=O)CCl)S(=O)(=O)N2CCOCC2)Cl

222415

건을2024-07-10부터공개중

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