| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1c4ccccc4N=C(N1)CCC(=O)NC(c2ccc(cc2)n3ccnc3)C |
| InChI | InChI | 1.03 | InChI=1S/C22H21N5O2/c1-15(16-6-8-17(9-7-16)27-13-12-23-14-27)24-21(28)11-10-20-25-19-5-3-2-4-18(19)22(29)26-20/h2-9,12-15H,10-11H2,1H3,(H,24,28)(H,25,26,29)/t15-/m0/s1 |
| InChIKey | InChI | 1.03 | CXFUNVLSNZEBDZ-HNNXBMFYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | C[C@H](NC(=O)CCC1=Nc2ccccc2C(=O)N1)c3ccc(cc3)n4ccnc4 |
| SMILES | CACTVS | 3.370 | C[CH](NC(=O)CCC1=Nc2ccccc2C(=O)N1)c3ccc(cc3)n4ccnc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C[C@@H](c1ccc(cc1)n2ccnc2)NC(=O)CCC3=Nc4ccccc4C(=O)N3 |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC(c1ccc(cc1)n2ccnc2)NC(=O)CCC3=Nc4ccccc4C(=O)N3 |
