ZYQ
Summary
| Name: | N-(4-OXO-5,6,7,8-TETRAHYDRO-4H-[1,3]THIAZOLO[5,4-C]AZEPIN-2-YL)ACETAMIDE |
| Formula: | C9 H11 N3 O2 S |
| Formal charge: | 0 |
| Formula weight: | 225.268 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | N-(4-oxo-5,6,7,8-tetrahydro-4H-[1,3]thiazolo[5,4-c]azepin-2-yl)acetamide |
| OpenEye OEToolkits | 1.6.1 | N-(4-oxo-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-c]azepin-2-yl)ethanamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1NCCCc2nc(sc12)NC(=O)C |
| SMILES_CANONICAL | CACTVS | 3.352 | CC(=O)Nc1sc2C(=O)NCCCc2n1 |
| SMILES | CACTVS | 3.352 | CC(=O)Nc1sc2C(=O)NCCCc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | CC(=O)Nc1nc2c(s1)C(=O)NCCC2 |
| SMILES | OpenEye OEToolkits | 1.6.1 | CC(=O)Nc1nc2c(s1)C(=O)NCCC2 |
| InChI | InChI | 1.03 | InChI=1S/C9H11N3O2S/c1-5(13)11-9-12-6-3-2-4-10-8(14)7(6)15-9/h2-4H2,1H3,(H,10,14)(H,11,12,13) |
| InChIKey | InChI | 1.03 | OYHOEDBNAJPFKK-UHFFFAOYSA-N |
