Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C14H13F3N6O2S/c1-3-26-6-10-20-21-11-8(4-5-9(23(10)11)14(15,16)17)12(24)18-13-22-19-7(2)25-13/h4-5H,3,6H2,1-2H3,(H,18,22,24) |
InChIKey | InChI | 1.06 | HCPJQSRDQCYJQJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCSCc1nnc2n1c(ccc2C(=O)Nc3oc(C)nn3)C(F)(F)F |
SMILES | CACTVS | 3.385 | CCSCc1nnc2n1c(ccc2C(=O)Nc3oc(C)nn3)C(F)(F)F |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCSCc1nnc2n1c(ccc2C(=O)Nc3nnc(o3)C)C(F)(F)F |
SMILES | OpenEye OEToolkits | 2.0.7 | CCSCc1nnc2n1c(ccc2C(=O)Nc3nnc(o3)C)C(F)(F)F |