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I5F

Summary
Name:[1,2,4]triazolo[3,4-b][1,3]benzothiazol-6-ol
Formula:C8 H5 N3 O S
Formal charge:0
Formula weight:191.21 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.7[1,2,4]triazolo[3,4-b][1,3]benzothiazol-6-ol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C8H5N3OS/c12-5-1-2-6-7(3-5)13-8-10-9-4-11(6)8/h1-4,12H
InChIKeyInChI1.06IWIXTZQBCXYDRG-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1ccc2n3cnnc3sc2c1
SMILESCACTVS3.385Oc1ccc2n3cnnc3sc2c1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc2c(cc1O)sc3n2cnn3
SMILESOpenEye OEToolkits2.0.7c1cc2c(cc1O)sc3n2cnn3

222415

PDB entries from 2024-07-10

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