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U39

Summary
Name:2-[(cyclopropanesulfonyl)amino]-N-(2-ethoxyphenyl)benzamide
Formula:C18 H20 N2 O4 S
Formal charge:0
Formula weight:360.427 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-[(cyclopropanesulfonyl)amino]-N-(2-ethoxyphenyl)benzamide
OpenEye OEToolkits2.0.72-(cyclopropylsulfonylamino)-~{N}-(2-ethoxyphenyl)benzamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(Nc1ccccc1C(=O)Nc1ccccc1OCC)C1CC1
InChIInChI1.06InChI=1S/C18H20N2O4S/c1-2-24-17-10-6-5-9-16(17)19-18(21)14-7-3-4-8-15(14)20-25(22,23)13-11-12-13/h3-10,13,20H,2,11-12H2,1H3,(H,19,21)
InChIKeyInChI1.06RCSLEKLNDJJJLF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCOc1ccccc1NC(=O)c2ccccc2N[S](=O)(=O)C3CC3
SMILESCACTVS3.385CCOc1ccccc1NC(=O)c2ccccc2N[S](=O)(=O)C3CC3
SMILES_CANONICALOpenEye OEToolkits2.0.7CCOc1ccccc1NC(=O)c2ccccc2NS(=O)(=O)C3CC3
SMILESOpenEye OEToolkits2.0.7CCOc1ccccc1NC(=O)c2ccccc2NS(=O)(=O)C3CC3

224931

PDB entries from 2024-09-11

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