U73
Summary
| Name: | N-(5-ISOPROPYL-THIAZOL-2-YL)-2-PYRIDIN-3-YL-ACETAMIDE |
| Formula: | C13 H15 N3 O S |
| Formal charge: | 0 |
| Formula weight: | 261.343 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-[(2Z)-5-(1-methylethyl)-1,3-thiazol-2(3H)-ylidene]-2-pyridin-3-ylacetamide |
| OpenEye OEToolkits | 1.5.0 | (NZ)-N-(5-propan-2-yl-3H-1,3-thiazol-2-ylidene)-2-pyridin-3-yl-ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(\N=C1/SC(=CN1)C(C)C)Cc2cccnc2 |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)C1=CNC(S1)=NC(=O)Cc2cccnc2 |
| SMILES | CACTVS | 3.341 | CC(C)C1=CNC(S1)=NC(=O)Cc2cccnc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC(C)C1=CN/C(=N/C(=O)Cc2cccnc2)/S1 |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC(C)C1=CNC(=NC(=O)Cc2cccnc2)S1 |
| InChI | InChI | 1.03 | InChI=1S/C13H15N3OS/c1-9(2)11-8-15-13(18-11)16-12(17)6-10-4-3-5-14-7-10/h3-5,7-9H,6H2,1-2H3,(H,15,16,17) |
| InChIKey | InChI | 1.03 | WQZOOPQQADNJEG-UHFFFAOYSA-N |
