| PDB CCD ID: | ZMG |
| Number of entries in BioLiP: | 4 |
| Chemical formula: | C12 H13 F N2 O S |
| InChI: | InChI=1S/C12H13FN2OS/c1-7(2)10-11(16)15-12(17-10)14-9-6-4-3-5-8(9)13/h3-7,10H,1-2H3,(H,14,15,16)/t10-/m1/s1 |
| InChIKey: | OJJBBNIYQKFZDK-SNVBAGLBSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.341 | CC(C)[CH]1SC(=NC1=O)Nc2ccccc2F | | OpenEye OEToolkits 1.5.0 | CC(C)C1C(=O)N=C(S1)Nc2ccccc2F | | CACTVS 3.341 | CC(C)[C@H]1SC(=NC1=O)Nc2ccccc2F | | ACDLabs 10.04 | Fc1ccccc1NC2=NC(=O)C(S2)C(C)C | | OpenEye OEToolkits 1.5.0 | CC(C)[C@@H]1C(=O)N=C(S1)Nc2ccccc2F |
|
| Name: | (5R)-2-[(2-fluorophenyl)amino]-5-(1-methylethyl)-1,3-thiazol-4(5H)-one;
(R)-2-(2-fluorophenylamino)-5-isopropylthiazol-4(5H)-one |
| ChEMBL: | CHEMBL392452 |
| DrugBank: | DB08771 |
| ZINC: | ZINC000016052518 |
umich.edu