6JH
Summary
| Name: | 2-(2-phenoxypyridin-3-yl)[1,3]thiazolo[5,4-c]pyridine |
| Formula: | C17 H11 N3 O S |
| Formal charge: | 0 |
| Formula weight: | 305.354 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 2-(2-phenoxypyridin-3-yl)[1,3]thiazolo[5,4-c]pyridine |
| OpenEye OEToolkits | 2.0.4 | 2-(2-phenoxypyridin-3-yl)-[1,3]thiazolo[5,4-c]pyridine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1ccccc1Oc4c(c3nc2ccncc2s3)cccn4 |
| InChI | InChI | 1.03 | InChI=1S/C17H11N3OS/c1-2-5-12(6-3-1)21-16-13(7-4-9-19-16)17-20-14-8-10-18-11-15(14)22-17/h1-11H |
| InChIKey | InChI | 1.03 | BEFVRNYCLDLVCZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O(c1ccccc1)c2ncccc2c3sc4cnccc4n3 |
| SMILES | CACTVS | 3.385 | O(c1ccccc1)c2ncccc2c3sc4cnccc4n3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1ccc(cc1)Oc2c(cccn2)c3nc4ccncc4s3 |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1ccc(cc1)Oc2c(cccn2)c3nc4ccncc4s3 |
