| PDB CCD ID: | 5P9 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C15 H11 Cl N2 O2 |
| InChI: | InChI=1S/C15H11ClN2O2/c16-9-5-6-14(17-8-9)18-15(20)12-7-13(19)11-4-2-1-3-10(11)12/h1-6,8,12H,7H2,(H,17,18,20)/t12-/m1/s1 |
| InChIKey: | SHUGQXDCDVWNCL-GFCCVEGCSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | Clc1ccc(NC(=O)[CH]2CC(=O)c3ccccc23)nc1 | | OpenEye OEToolkits 2.0.7 | c1ccc2c(c1)C(CC2=O)C(=O)Nc3ccc(cn3)Cl | | OpenEye OEToolkits 2.0.7 | c1ccc2c(c1)[C@@H](CC2=O)C(=O)Nc3ccc(cn3)Cl | | CACTVS 3.385 | Clc1ccc(NC(=O)[C@@H]2CC(=O)c3ccccc23)nc1 |
|
| Name: | N-(5-chloropyridin-2-yl)-3-oxo-2,3-dihydro-1H-indene-1-carboxamide;
(1~{R})-~{N}-(5-chloranylpyridin-2-yl)-3-oxidanylidene-1,2-dihydroindene-1-carboxamide |
| ZINC: | ZINC000038488460 |
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