PDB CCD ID: | 5ML |
Number of entries in BioLiP: | 2 |
Chemical formula: | C28 H28 N4 O |
InChI: | InChI=1S/C28H28N4O/c1-20-6-5-8-23(16-20)28(33)30-26-18-21(10-11-27(26)32-14-12-31(2)13-15-32)24-17-22-7-3-4-9-25(22)29-19-24/h3-11,16-19H,12-15H2,1-2H3,(H,30,33) |
InChIKey: | SGTMEYAZQRHDJV-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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OpenEye OEToolkits 2.0.4 | Cc1cccc(c1)C(=O)Nc2cc(ccc2N3CCN(CC3)C)c4cc5ccccc5nc4 | CACTVS 3.385 | CN1CCN(CC1)c2ccc(cc2NC(=O)c3cccc(C)c3)c4cnc5ccccc5c4 |
|
Name: | 3-methyl-~{N}-[2-(4-methylpiperazin-1-yl)-5-quinolin-3-yl-phenyl]benzamide |
ChEMBL: | CHEMBL3798573 |
ZINC: | ZINC000263621038 |