| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C23H28N4O3/c1-3-30-25-18-20-4-6-22(7-5-20)29-17-11-19(2)10-14-26-15-16-27(23(26)28)21-8-12-24-13-9-21/h4-9,12-13,15-16,18-19H,3,10-11,14,17H2,1-2H3/b25-18- |
| InChIKey | InChI | 1.03 | JVWDSRHSJUZDAL-BWAHOGKJSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCO\N=C/c1ccc(OCC[C@@H](C)CCN2C=CN(C2=O)c3ccncc3)cc1 |
| SMILES | CACTVS | 3.385 | CCON=Cc1ccc(OCC[CH](C)CCN2C=CN(C2=O)c3ccncc3)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | CCON=Cc1ccc(cc1)OCCC(C)CCN2C=CN(C2=O)c3ccncc3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | CCON=Cc1ccc(cc1)OCCC(C)CCN2C=CN(C2=O)c3ccncc3 |
