PDB CCD ID: | ZEG |
Number of entries in BioLiP: | 1 |
Chemical formula: | C19 H17 F N2 O3 S2 |
InChI: | InChI=1S/C19H17FN2O3S2/c20-16-5-1-15(2-6-16)19-21-18(13-26-19)14-3-7-17(8-4-14)27(23,24)22-9-11-25-12-10-22/h1-8,13H,9-12H2 |
InChIKey: | JYTYZKKXJTUPJO-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
CACTVS 3.385 | Fc1ccc(cc1)c2scc(n2)c3ccc(cc3)[S](=O)(=O)N4CCOCC4 | OpenEye OEToolkits 2.0.7 | c1cc(ccc1c2nc(cs2)c3ccc(cc3)S(=O)(=O)N4CCOCC4)F | ACDLabs 12.01 | O=S(=O)(N1CCOCC1)c1ccc(cc1)c1csc(n1)c1ccc(F)cc1 |
|
Name: | 4-{4-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]benzene-1-sulfonyl}morpholine |
ZINC: | ZINC000008225552 |