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RNN

Summary
Name:N,N'-(benzene-1,4-diyldiethane-2,1-diyl)dipropane-2-sulfonamide
Formula:C16 H28 N2 O4 S2
Formal charge:0
Formula weight:376.535 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.01N,N'-(benzene-1,4-diyldiethane-2,1-diyl)dipropane-2-sulfonamide
OpenEye OEToolkits1.7.2N-[2-[4-[2-(propan-2-ylsulfonylamino)ethyl]phenyl]ethyl]propane-2-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O=S(=O)(NCCc1ccc(cc1)CCNS(=O)(=O)C(C)C)C(C)C
SMILES_CANONICALCACTVS3.370CC(C)[S](=O)(=O)NCCc1ccc(CCN[S](=O)(=O)C(C)C)cc1
SMILESCACTVS3.370CC(C)[S](=O)(=O)NCCc1ccc(CCN[S](=O)(=O)C(C)C)cc1
SMILES_CANONICALOpenEye OEToolkits1.7.2CC(C)S(=O)(=O)NCCc1ccc(cc1)CCNS(=O)(=O)C(C)C
SMILESOpenEye OEToolkits1.7.2CC(C)S(=O)(=O)NCCc1ccc(cc1)CCNS(=O)(=O)C(C)C
InChIInChI1.03InChI=1S/C16H28N2O4S2/c1-13(2)23(19,20)17-11-9-15-5-7-16(8-6-15)10-12-18-24(21,22)14(3)4/h5-8,13-14,17-18H,9-12H2,1-4H3
InChIKeyInChI1.03FHLGMMYEKXPVSC-UHFFFAOYSA-N

220113

PDB entries from 2024-05-22

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