PDB CCD ID: | VOF |
Number of entries in BioLiP: | 1 |
Chemical formula: | C10 H8 F2 N3 O |
InChI: | InChI=1S/C10H8F2N3O/c11-10(15-7-14(12)6-13-15)9(16)8-4-2-1-3-5-8/h1-7,10H/t10-/m0/s1 |
InChIKey: | RVNIFDQWHFAHJY-JTQLQIEISA-N |
SMILES: | Software | SMILES |
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CACTVS 3.385 | F[CH](n1c[n](F)cn1)C(=O)c2ccccc2 | OpenEye OEToolkits 2.0.7 | c1ccc(cc1)C(=O)[C@H](N2C=[N](C=N2)F)F | CACTVS 3.385 | F[C@@H](n1c[n](F)cn1)C(=O)c2ccccc2 | OpenEye OEToolkits 2.0.7 | c1ccc(cc1)C(=O)C(N2C=[N](C=N2)F)F |
|
Name: | (2~{R})-2-fluoranyl-2-(4-fluoranyl-1,2,4$l^{4}-triazacyclopenta-2,4-dien-1-yl)-1-phenyl-ethanone |