BU5
Summary
| Name: | [2-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazol-4-yl]methanol |
| Formula: | C11 H9 N3 O S |
| Formal charge: | 0 |
| Formula weight: | 231.274 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | [2-(1~{H}-pyrrolo[2,3-b]pyridin-4-yl)-1,3-thiazol-4-yl]methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C11H9N3OS/c15-5-7-6-16-11(14-7)9-2-4-13-10-8(9)1-3-12-10/h1-4,6,15H,5H2,(H,12,13) |
| InChIKey | InChI | 1.03 | DEQVBJXGQZCGGU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCc1csc(n1)c2ccnc3[nH]ccc23 |
| SMILES | CACTVS | 3.385 | OCc1csc(n1)c2ccnc3[nH]ccc23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1c[nH]c2c1c(ccn2)c3nc(cs3)CO |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1c[nH]c2c1c(ccn2)c3nc(cs3)CO |
