PDB CCD ID: | 2LK |
Number of entries in BioLiP: | 4 |
Chemical formula: | C19 H16 Cl N3 O |
InChI: | InChI=1S/C19H16ClN3O/c1-12-19(13(2)24-22-12)15-5-8-18-17(9-15)21-11-23(18)10-14-3-6-16(20)7-4-14/h3-9,11H,10H2,1-2H3 |
InChIKey: | WPKUYRYYDUHEAQ-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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ACDLabs 12.01 | Clc1ccc(cc1)Cn2c4c(nc2)cc(c3c(onc3C)C)cc4 | OpenEye OEToolkits 1.7.6 | Cc1c(c(on1)C)c2ccc3c(c2)ncn3Cc4ccc(cc4)Cl | CACTVS 3.385 | Cc1onc(C)c1c2ccc3n(Cc4ccc(Cl)cc4)cnc3c2 |
|
Name: | 1-(4-chlorobenzyl)-5-(3,5-dimethyl-1,2-oxazol-4-yl)-1H-benzimidazole |
ChEMBL: | CHEMBL3220864 |
ZINC: | ZINC000095921428 |