| PDB CCD ID: | VJF |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C14 H15 N3 O6 S2 |
| InChI: | InChI=1S/C14H15N3O6S2/c18-12(16-14-17(21)10(9-24-14)8-13(19)20)6-7-15-25(22,23)11-4-2-1-3-5-11/h1-5,9,15,21H,6-8H2,(H,19,20)/b16-14- |
| InChIKey: | MHACTLSRQSKDHU-PEZBUJJGSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | ON1C(=CSC1=NC(=O)CCN[S](=O)(=O)c2ccccc2)CC(O)=O | | OpenEye OEToolkits 2.0.7 | c1ccc(cc1)S(=O)(=O)NCCC(=O)N=C2N(C(=CS2)CC(=O)O)O | | OpenEye OEToolkits 2.0.7 | c1ccc(cc1)S(=O)(=O)NCCC(=O)/N=C\2/N(C(=CS2)CC(=O)O)O |
|
| Name: | 2-[(2~{Z})-3-oxidanyl-2-[3-(phenylsulfonylamino)propanoylimino]-1,3-thiazol-4-yl]ethanoic acid |
umich.edu