TJ9
Summary
| Name: | ~{N}-[5-(2-azanyl-1,3-thiazol-4-yl)-4-methyl-1,3-thiazol-2-yl]ethanamide |
| Formula: | C9 H10 N4 O S2 |
| Formal charge: | 0 |
| Formula weight: | 254.332 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-[5-(2-azanyl-1,3-thiazol-4-yl)-4-methyl-1,3-thiazol-2-yl]ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C9H10N4OS2/c1-4-7(6-3-15-8(10)13-6)16-9(11-4)12-5(2)14/h3H,1-2H3,(H2,10,13)(H,11,12,14) |
| InChIKey | InChI | 1.06 | HJVCYSMRXGHUDT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1sc(c(C)n1)c2csc(N)n2 |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1sc(c(C)n1)c2csc(N)n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1c(sc(n1)NC(=O)C)c2csc(n2)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1c(sc(n1)NC(=O)C)c2csc(n2)N |
