J6W
Summary
| Name: | (5-methyl-1-benzothiophen-2-yl)methanol |
| Formula: | C10 H10 O S |
| Formal charge: | 0 |
| Formula weight: | 178.251 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (5-methyl-1-benzothiophen-2-yl)methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H10OS/c1-7-2-3-10-8(4-7)5-9(6-11)12-10/h2-5,11H,6H2,1H3 |
| InChIKey | InChI | 1.03 | NPSSZIBANMLQHP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc2sc(CO)cc2c1 |
| SMILES | CACTVS | 3.385 | Cc1ccc2sc(CO)cc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1ccc2c(c1)cc(s2)CO |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1ccc2c(c1)cc(s2)CO |
