| PDB CCD ID: | QK0 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C20 H14 Cl F N4 O3 S2 |
| InChI: | InChI=1S/C20H14ClFN4O3S2/c1-11(27)24-20-25-16-7-2-12(9-18(16)30-20)13-8-17(19(21)23-10-13)26-31(28,29)15-5-3-14(22)4-6-15/h2-10,26H,1H3,(H,24,25,27) |
| InChIKey: | YGBMCLDVRUGXOV-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| ACDLabs 12.01 | Fc1ccc(cc1)S(=O)(=O)Nc4cc(c2ccc3nc(sc3c2)NC(=O)C)cnc4Cl | | OpenEye OEToolkits 1.7.0 | CC(=O)Nc1nc2ccc(cc2s1)c3cc(c(nc3)Cl)NS(=O)(=O)c4ccc(cc4)F | | CACTVS 3.370 | CC(=O)Nc1sc2cc(ccc2n1)c3cnc(Cl)c(N[S](=O)(=O)c4ccc(F)cc4)c3 |
|
| Name: | N-[6-(6-chloro-5-{[(4-fluorophenyl)sulfonyl]amino}pyridin-3-yl)-1,3-benzothiazol-2-yl]acetamide |
| ChEMBL: | CHEMBL1615189 |
| ZINC: | ZINC000064744203 |
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