J6X
Summary
Name: | 2-(4-methyl-1,3-thiazol-2-yl)-1-benzothiophen-3-ol |
Formula: | C12 H9 N O S2 |
Formal charge: | 0 |
Formula weight: | 247.336 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 2-(4-methyl-1,3-thiazol-2-yl)-1-benzothiophen-3-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C12H9NOS2/c1-7-6-15-12(13-7)11-10(14)8-4-2-3-5-9(8)16-11/h2-6,14H,1H3 |
InChIKey | InChI | 1.06 | CKTCKDPHWPJIPT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1csc(n1)c2sc3ccccc3c2O |
SMILES | CACTVS | 3.385 | Cc1csc(n1)c2sc3ccccc3c2O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1csc(n1)c2c(c3ccccc3s2)O |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1csc(n1)c2c(c3ccccc3s2)O |