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407

Summary
Name:N~2~-[(4-fluoro-3-methylphenyl)sulfonyl]-N-hydroxy-D-alaninamide
Formula:C10 H13 F N2 O4 S
Formal charge:0
Formula weight:276.285 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N~2~-[(4-fluoro-3-methylphenyl)sulfonyl]-N-hydroxy-D-alaninamide
OpenEye OEToolkits1.9.2(2R)-2-[(4-fluoranyl-3-methyl-phenyl)sulfonylamino]-N-oxidanyl-propanamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Fc1c(cc(cc1)S(=O)(=O)NC(C(=O)NO)C)C
InChIInChI1.03InChI=1S/C10H13FN2O4S/c1-6-5-8(3-4-9(6)11)18(16,17)13-7(2)10(14)12-15/h3-5,7,13,15H,1-2H3,(H,12,14)/t7-/m1/s1
InChIKeyInChI1.03PGNDHTMCXOFNMS-SSDOTTSWSA-N
SMILES_CANONICALCACTVS3.385C[C@@H](N[S](=O)(=O)c1ccc(F)c(C)c1)C(=O)NO
SMILESCACTVS3.385C[CH](N[S](=O)(=O)c1ccc(F)c(C)c1)C(=O)NO
SMILES_CANONICALOpenEye OEToolkits1.9.2Cc1cc(ccc1F)S(=O)(=O)N[C@H](C)C(=O)NO
SMILESOpenEye OEToolkits1.9.2Cc1cc(ccc1F)S(=O)(=O)NC(C)C(=O)NO

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건을2024-07-10부터공개중

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