| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C1Oc2ccc(cc2N1C)C(=O)Nc1ccc2N(CC#CC)C(=O)c3ccc(F)cc3Sc2c1 |
| InChI | InChI | 1.06 | InChI=1S/C26H18FN3O4S/c1-3-4-11-30-19-9-7-17(14-23(19)35-22-13-16(27)6-8-18(22)25(30)32)28-24(31)15-5-10-21-20(12-15)29(2)26(33)34-21/h5-10,12-14H,11H2,1-2H3,(H,28,31) |
| InChIKey | InChI | 1.06 | RFCSFVZTHMAECY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC#CCN1C(=O)c2ccc(F)cc2Sc3cc(NC(=O)c4ccc5OC(=O)N(C)c5c4)ccc13 |
| SMILES | CACTVS | 3.385 | CC#CCN1C(=O)c2ccc(F)cc2Sc3cc(NC(=O)c4ccc5OC(=O)N(C)c5c4)ccc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CC#CCN1c2ccc(cc2Sc3cc(ccc3C1=O)F)NC(=O)c4ccc5c(c4)N(C(=O)O5)C |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CC#CCN1c2ccc(cc2Sc3cc(ccc3C1=O)F)NC(=O)c4ccc5c(c4)N(C(=O)O5)C |
