A1IK7
Summary
| Name: | N-(7-chloro-1,3-benzothiazol-2-yl)-3-hydroxy-benzenesulfonamide |
| Formula: | C13 H9 Cl N2 O3 S2 |
| Formal charge: | 0 |
| Formula weight: | 340.805 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ~{N}-(7-chloranyl-1,3-benzothiazol-2-yl)-3-oxidanyl-benzenesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C13H9ClN2O3S2/c14-10-5-2-6-11-12(10)20-13(15-11)16-21(18,19)9-4-1-3-8(17)7-9/h1-7,17H,(H,15,16) |
| InChIKey | InChI | 1.06 | IYYXRTKFNAKTKU-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1cccc(c1)[S](=O)(=O)Nc2sc3c(Cl)cccc3n2 |
| SMILES | CACTVS | 3.385 | Oc1cccc(c1)[S](=O)(=O)Nc2sc3c(Cl)cccc3n2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)S(=O)(=O)Nc2nc3cccc(c3s2)Cl)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(cc(c1)S(=O)(=O)Nc2nc3cccc(c3s2)Cl)O |
