J38
Summary
| Name: | (2R)-2-methyl-3-oxo-4H-1,4-benzothiazine-6-carbohydroxamic acid |
| Formula: | C10 H10 N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 238.263 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-2-methyl-N,3-dioxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxamide |
| OpenEye OEToolkits | 1.7.6 | (2R)-2-methyl-N-oxidanyl-3-oxidanylidene-4H-1,4-benzothiazine-6-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=NC(=O)c2ccc1SC(C(=O)Nc1c2)C |
| InChI | InChI | 1.03 | InChI=1S/C10H8N2O3S/c1-5-9(13)11-7-4-6(10(14)12-15)2-3-8(7)16-5/h2-5H,1H3,(H,11,13)/t5-/m1/s1 |
| InChIKey | InChI | 1.03 | YALBEYHVOFQECJ-RXMQYKEDSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H]1Sc2ccc(cc2NC1=O)C(=O)NO |
| SMILES | CACTVS | 3.385 | C[CH]1Sc2ccc(cc2NC1=O)C(=O)NO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C[C@@H]1C(=O)Nc2cc(ccc2S1)C(=O)NO |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC1C(=O)Nc2cc(ccc2S1)C(=O)NO |
