IQ5
Summary
| Name: | N-(2-AZANYL-6-METHYL-1,3-BENZOTHIAZOL-5-YL)ETHANAMIDE |
| Formula: | C10 H11 N3 O S |
| Formal charge: | 0 |
| Formula weight: | 221.279 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | N-(2-azanyl-6-methyl-1,3-benzothiazol-5-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H11N3OS/c1-5-3-9-8(13-10(11)15-9)4-7(5)12-6(2)14/h3-4H,1-2H3,(H2,11,13)(H,12,14) |
| InChIKey | InChI | 1.03 | DUWIACCTNKYBNV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1cc2nc(N)sc2cc1C |
| SMILES | CACTVS | 3.385 | CC(=O)Nc1cc2nc(N)sc2cc1C |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1cc2c(cc1NC(=O)C)nc(s2)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cc1cc2c(cc1NC(=O)C)nc(s2)N |
