Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C2N5C(=O)NC(=O)C5Cc3c1ccccc1n(c23)Cc4ccc(cc4)F |
InChI | InChI | 1.03 | InChI=1S/C20H16FN3O2/c21-13-7-5-12(6-8-13)10-23-16-4-2-1-3-14(16)15-9-17-19(25)22-20(26)24(17)11-18(15)23/h1-8,17H,9-11H2,(H,22,25,26)/t17-/m0/s1 |
InChIKey | InChI | 1.03 | LRGAZQBFSHLAGN-KRWDZBQOSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc(Cn2c3CN4[C@@H](Cc3c5ccccc25)C(=O)NC4=O)cc1 |
SMILES | CACTVS | 3.385 | Fc1ccc(Cn2c3CN4[CH](Cc3c5ccccc25)C(=O)NC4=O)cc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc2c(c1)c3c(n2Cc4ccc(cc4)F)CN5[C@@H](C3)C(=O)NC5=O |
SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc2c(c1)c3c(n2Cc4ccc(cc4)F)CN5C(C3)C(=O)NC5=O |