| PDB CCD ID: | F77 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C16 H16 F N O4 S |
| InChI: | InChI=1S/C16H16FNO4S/c1-3-11-4-9-14(15(10(11)2)16(19)20)18-23(21,22)13-7-5-12(17)6-8-13/h4-9,18H,3H2,1-2H3,(H,19,20) |
| InChIKey: | MGUQWAOYPINSIT-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | CCc1ccc(c(c1C)C(=O)O)NS(=O)(=O)c2ccc(cc2)F | | CACTVS 3.341 | CCc1ccc(N[S](=O)(=O)c2ccc(F)cc2)c(C(O)=O)c1C | | ACDLabs 10.04 | O=S(=O)(Nc1ccc(c(c1C(=O)O)C)CC)c2ccc(F)cc2 |
|
| Name: | 3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}-2-METHYLBENZOIC ACID;
3-ETHYL-6-(4-FLUORO-BENZENESULFONYLAMINO)-2-METHYL-BENZOIC ACID |
| ChEMBL: | CHEMBL230172 |
| DrugBank: | DB07746 |
| ZINC: | ZINC000014965037 |
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