PDB CCD ID: | VIZ |
Number of entries in BioLiP: | 1 |
Chemical formula: | C18 H16 N2 O6 S2 |
InChI: | InChI=1S/C18H16N2O6S2/c21-16(19-18-20(24)15(9-27-18)8-17(22)23)11-28(25,26)10-12-5-6-13-3-1-2-4-14(13)7-12/h1-7,9,24H,8,10-11H2,(H,22,23)/b19-18- |
InChIKey: | QNCNQHCDQMPPGD-HNENSFHCSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 2.0.7 | c1ccc2cc(ccc2c1)CS(=O)(=O)CC(=O)N=C3N(C(=CS3)CC(=O)O)O | CACTVS 3.385 | ON1C(=CSC1=NC(=O)C[S](=O)(=O)Cc2ccc3ccccc3c2)CC(O)=O | OpenEye OEToolkits 2.0.7 | c1ccc2cc(ccc2c1)CS(=O)(=O)CC(=O)/N=C\3/N(C(=CS3)CC(=O)O)O |
|
Name: | 2-[(2~{Z})-2-[2-(naphthalen-2-ylmethylsulfonyl)ethanoylimino]-3-oxidanyl-1,3-thiazol-4-yl]ethanoic acid |
ChEMBL: | CHEMBL2312530 |
ZINC: | ZINC000095596218 |