Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C22H19N3O2/c1-2-27-18-10-6-9-16(13-18)17-11-12-19-20(14-17)24-25-21(19)23-22(26)15-7-4-3-5-8-15/h3-14H,2H2,1H3,(H2,23,24,25,26) |
InChIKey | InChI | 1.03 | QKJLYUUEYRTLCL-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCOc1cccc(c1)c2ccc3c([nH]nc3NC(=O)c4ccccc4)c2 |
SMILES | CACTVS | 3.385 | CCOc1cccc(c1)c2ccc3c([nH]nc3NC(=O)c4ccccc4)c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOc1cccc(c1)c2ccc3c(c2)[nH]nc3NC(=O)c4ccccc4 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCOc1cccc(c1)c2ccc3c(c2)[nH]nc3NC(=O)c4ccccc4 |