Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | CC(=O)Nc1ccc(cc1)c1csc(Nc2ccc(F)cc2)n1 |
InChI | InChI | 1.03 | InChI=1S/C17H14FN3OS/c1-11(22)19-14-6-2-12(3-7-14)16-10-23-17(21-16)20-15-8-4-13(18)5-9-15/h2-10H,1H3,(H,19,22)(H,20,21) |
InChIKey | InChI | 1.03 | SCEDDLGSZVKJMY-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)c2csc(Nc3ccc(F)cc3)n2 |
SMILES | CACTVS | 3.385 | CC(=O)Nc1ccc(cc1)c2csc(Nc3ccc(F)cc3)n2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1ccc(cc1)c2csc(n2)Nc3ccc(cc3)F |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(=O)Nc1ccc(cc1)c2csc(n2)Nc3ccc(cc3)F |