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O6Z

Summary
Name:~{N}-(1~{H}-indazol-5-yl)butane-1-sulfonamide
Formula:C11 H15 N3 O2 S
Formal charge:0
Formula weight:253.321 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7~{N}-(1~{H}-indazol-5-yl)butane-1-sulfonamide

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C11H15N3O2S/c1-2-3-6-17(15,16)14-10-4-5-11-9(7-10)8-12-13-11/h4-5,7-8,14H,2-3,6H2,1H3,(H,12,13)
InChIKeyInChI1.03OPXDHLZGQKADDC-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CCCC[S](=O)(=O)Nc1ccc2[nH]ncc2c1
SMILESCACTVS3.385CCCC[S](=O)(=O)Nc1ccc2[nH]ncc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.7CCCCS(=O)(=O)Nc1ccc2c(c1)cn[nH]2
SMILESOpenEye OEToolkits2.0.7CCCCS(=O)(=O)Nc1ccc2c(c1)cn[nH]2

229183

PDB entries from 2024-12-18

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