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
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | [1,2,4]triazolo[3,4-b][1,3]benzothiazol-6-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C8H5N3OS/c12-5-1-2-6-7(3-5)13-8-10-9-4-11(6)8/h1-4,12H |
InChIKey | InChI | 1.06 | IWIXTZQBCXYDRG-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc2n3cnnc3sc2c1 |
SMILES | CACTVS | 3.385 | Oc1ccc2n3cnnc3sc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1O)sc3n2cnn3 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1O)sc3n2cnn3 |