Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)c3sccc3C(=O)Nc2ccc(c1cccc(OC)c1)cc2F |
SMILES_CANONICAL | CACTVS | 3.341 | COc1cccc(c1)c2ccc(NC(=O)c3ccsc3C(O)=O)c(F)c2 |
SMILES | CACTVS | 3.341 | COc1cccc(c1)c2ccc(NC(=O)c3ccsc3C(O)=O)c(F)c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COc1cccc(c1)c2ccc(c(c2)F)NC(=O)c3ccsc3C(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | COc1cccc(c1)c2ccc(c(c2)F)NC(=O)c3ccsc3C(=O)O |
InChI | InChI | 1.03 | InChI=1S/C19H14FNO4S/c1-25-13-4-2-3-11(9-13)12-5-6-16(15(20)10-12)21-18(22)14-7-8-26-17(14)19(23)24/h2-10H,1H3,(H,21,22)(H,23,24) |
InChIKey | InChI | 1.03 | GIUMGVUBDBDTDX-UHFFFAOYSA-N |