| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | Cc1nn(C)c2cc(ccc12)C(=O)NCCc1cocn1 |
| InChI | InChI | 1.06 | InChI=1S/C15H16N4O2/c1-10-13-4-3-11(7-14(13)19(2)18-10)15(20)16-6-5-12-8-21-9-17-12/h3-4,7-9H,5-6H2,1-2H3,(H,16,20) |
| InChIKey | InChI | 1.06 | LIYDFYCGCLXSCX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cn1nc(C)c2ccc(cc12)C(=O)NCCc3cocn3 |
| SMILES | CACTVS | 3.385 | Cn1nc(C)c2ccc(cc12)C(=O)NCCc3cocn3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | Cc1c2ccc(cc2n(n1)C)C(=O)NCCc3cocn3 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | Cc1c2ccc(cc2n(n1)C)C(=O)NCCc3cocn3 |
