JTY
Summary
| Name: | 5-(phenylsulfonylamino)-1,3-thiazole-4-carboxylic acid |
| Formula: | C10 H8 N2 O4 S2 |
| Formal charge: | 0 |
| Formula weight: | 284.312 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 5-(phenylsulfonylamino)-1,3-thiazole-4-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H8N2O4S2/c13-10(14)8-9(17-6-11-8)12-18(15,16)7-4-2-1-3-5-7/h1-6,12H,(H,13,14) |
| InChIKey | InChI | 1.03 | XOXXLROXAKZQOM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1ncsc1N[S](=O)(=O)c2ccccc2 |
| SMILES | CACTVS | 3.385 | OC(=O)c1ncsc1N[S](=O)(=O)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)S(=O)(=O)Nc2c(ncs2)C(=O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)S(=O)(=O)Nc2c(ncs2)C(=O)O |
