Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Fc1cccc(c1)NC(=O)c3sc2nc(ccc2c3N)c4sccc4 |
SMILES_CANONICAL | CACTVS | 3.341 | Nc1c(sc2nc(ccc12)c3sccc3)C(=O)Nc4cccc(F)c4 |
SMILES | CACTVS | 3.341 | Nc1c(sc2nc(ccc12)c3sccc3)C(=O)Nc4cccc(F)c4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(cc(c1)F)NC(=O)c2c(c3ccc(nc3s2)c4cccs4)N |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(cc(c1)F)NC(=O)c2c(c3ccc(nc3s2)c4cccs4)N |
InChI | InChI | 1.03 | InChI=1S/C18H12FN3OS2/c19-10-3-1-4-11(9-10)21-17(23)16-15(20)12-6-7-13(22-18(12)25-16)14-5-2-8-24-14/h1-9H,20H2,(H,21,23) |
InChIKey | InChI | 1.03 | UCTSEHMMSSIODN-UHFFFAOYSA-N |