| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2N(c1ccncc1)CCN2CCC(CCOc3ccc(\C=N\OCC)cc3)C |
| InChI | InChI | 1.03 | InChI=1S/C23H30N4O3/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/h4-9,12-13,18-19H,3,10-11,14-17H2,1-2H3/b25-18+/t19-/m0/s1 |
| InChIKey | InChI | 1.03 | IRYPPICIQPYQGY-YSRPOPIVSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCO\N=C\c1ccc(OCC[C@@H](C)CCN2CCN(C2=O)c3ccncc3)cc1 |
| SMILES | CACTVS | 3.385 | CCON=Cc1ccc(OCC[CH](C)CCN2CCN(C2=O)c3ccncc3)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CCO/N=C/c1ccc(cc1)OCC[C@@H](C)CCN2CCN(C2=O)c3ccncc3 |
| SMILES | OpenEye OEToolkits | 1.9.2 | CCON=Cc1ccc(cc1)OCCC(C)CCN2CCN(C2=O)c3ccncc3 |
