| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C1(NC(/N(C1=O)C)=N)(c3cc(NC(c2ccco2)=O)ccc3)c4ccccc4 |
| InChI | InChI | 1.03 | InChI=1S/C21H18N4O3/c1-25-19(27)21(24-20(25)22,14-7-3-2-4-8-14)15-9-5-10-16(13-15)23-18(26)17-11-6-12-28-17/h2-13H,1H3,(H2,22,24)(H,23,26)/t21-/m1/s1 |
| InChIKey | InChI | 1.03 | SOHROZVXKZYZIE-OAQYLSRUSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CN1C(=N)N[C@](C1=O)(c2ccccc2)c3cccc(NC(=O)c4occc4)c3 |
| SMILES | CACTVS | 3.385 | CN1C(=N)N[C](C1=O)(c2ccccc2)c3cccc(NC(=O)c4occc4)c3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | [H]/N=C/1\N[C@](C(=O)N1C)(c2ccccc2)c3cccc(c3)NC(=O)c4ccco4 |
| SMILES | OpenEye OEToolkits | 2.0.4 | CN1C(=O)C(NC1=N)(c2ccccc2)c3cccc(c3)NC(=O)c4ccco4 |
