H5E

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Summary

Name:6-[(4-~{tert}-butyl-1,3-thiazol-2-yl)methyl]-4,6-diazaspiro[2.4]heptane-5,7-dione
Formula:C13 H17 N3 O2 S
Formal charge:0
Molecular weight:279.358 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.66-[(4-~{tert}-butyl-1,3-thiazol-2-yl)methyl]-4,6-diazaspiro[2.4]heptane-5,7-dione

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C13H17N3O2S/c1-12(2,3)8-7-19-9(14-8)6-16-10(17)13(4-5-13)15-11(16)18/h7H,4-6H2,1-3H3,(H,15,18)
InChIKeyInChI1.03CFOGTQXOCWUQMT-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(C)(C)c1csc(CN2C(=O)NC3(CC3)C2=O)n1
SMILESCACTVS3.385CC(C)(C)c1csc(CN2C(=O)NC3(CC3)C2=O)n1
SMILES_CANONICALOpenEye OEToolkits2.0.6CC(C)(C)c1csc(n1)CN2C(=O)C3(CC3)NC2=O
SMILESOpenEye OEToolkits2.0.6CC(C)(C)c1csc(n1)CN2C(=O)C3(CC3)NC2=O