PDB CCD ID: | GZT |
Number of entries in BioLiP: | 1 |
Chemical formula: | C15 H12 F2 N2 O4 |
InChI: | InChI=1S/C15H12F2N2O4/c1-18-13(20)10-3-2-6-19(14(10)21)8-9-4-5-11-12(7-9)23-15(16,17)22-11/h2-7H,8H2,1H3,(H,18,20) |
InChIKey: | AUOUHYVJJFEJOE-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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CACTVS 3.385 | CNC(=O)C1=CC=CN(Cc2ccc3OC(F)(F)Oc3c2)C1=O | OpenEye OEToolkits 2.0.6 | CNC(=O)C1=CC=CN(C1=O)Cc2ccc3c(c2)OC(O3)(F)F |
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Name: | 1-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]methyl]-~{N}-methyl-2-oxidanylidene-pyridine-3-carboxamide |
ZINC: | ZINC000001391167 |