| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C21H24N4O2/c1-3-5-6-20(26)24-19-10-8-16(13-22-19)15-7-9-18-17(12-15)21(27)25(11-4-2)14-23-18/h7-10,12-14H,3-6,11H2,1-2H3,(H,22,24,26) |
| InChIKey | InChI | 1.06 | CMSIAWXDJIGAGC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCC(=O)Nc1ccc(cn1)c2ccc3N=CN(CCC)C(=O)c3c2 |
| SMILES | CACTVS | 3.385 | CCCCC(=O)Nc1ccc(cn1)c2ccc3N=CN(CCC)C(=O)c3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCCCC(=O)Nc1ccc(cn1)c2ccc3c(c2)C(=O)N(C=N3)CCC |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCCCC(=O)Nc1ccc(cn1)c2ccc3c(c2)C(=O)N(C=N3)CCC |
