Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C20H19F2N3O3/c1-10-23-14-6-11(20(26)25(2)3)7-17(19(14)24-10)28-15-4-5-27-16-9-12(21)8-13(22)18(15)16/h6-9,15H,4-5H2,1-3H3,(H,23,24)/t15-/m0/s1 |
InChIKey | InChI | 1.03 | CLIQCDHNPDMGSL-HNNXBMFYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CN(C)C(=O)c1cc2[nH]c(C)nc2c(O[C@H]3CCOc4cc(F)cc(F)c34)c1 |
SMILES | CACTVS | 3.385 | CN(C)C(=O)c1cc2[nH]c(C)nc2c(O[CH]3CCOc4cc(F)cc(F)c34)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1[nH]c2cc(cc(c2n1)O[C@H]3CCOc4c3c(cc(c4)F)F)C(=O)N(C)C |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1[nH]c2cc(cc(c2n1)OC3CCOc4c3c(cc(c4)F)F)C(=O)N(C)C |