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CGD

Summary
Name:1,3-benzothiazol-2-ol
Formula:C7 H5 N O S
Formal charge:0
Formula weight:151.186 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.011,3-benzothiazol-2-ol
OpenEye OEToolkits2.0.61,3-benzothiazol-2-ol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1ccc2c(c1)sc(O)n2
InChIInChI1.03InChI=1S/C7H5NOS/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)
InChIKeyInChI1.03YEDUAINPPJYDJZ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1sc2ccccc2n1
SMILESCACTVS3.385Oc1sc2ccccc2n1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccc2c(c1)nc(s2)O
SMILESOpenEye OEToolkits2.0.6c1ccc2c(c1)nc(s2)O

218853

PDB entries from 2024-04-24

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