| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n1ccccc1/C(=N/c7ccc(c5oc(c4c(OC2CCNCC2)cc(\N=C(\c3ncccc3)N)cc4)cc5)c(OC6CCNCC6)c7)N |
| SMILES_CANONICAL | CACTVS | 3.370 | NC(=Nc1ccc(c2oc(cc2)c3ccc(cc3OC4CCNCC4)N=C(N)c5ccccn5)c(OC6CCNCC6)c1)c7ccccn7 |
| SMILES | CACTVS | 3.370 | NC(=Nc1ccc(c2oc(cc2)c3ccc(cc3OC4CCNCC4)N=C(N)c5ccccn5)c(OC6CCNCC6)c1)c7ccccn7 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(ncc1)/C(=N/c2cc(c(cc2)c3oc(cc3)c4c(cc(cc4)/N=C(\N)/c5ncccc5)OC6CCNCC6)OC7CCNCC7)/N |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1ccnc(c1)C(=Nc2ccc(c(c2)OC3CCNCC3)c4ccc(o4)c5ccc(cc5OC6CCNCC6)N=C(c7ccccn7)N)N |
| InChI | InChI | 1.03 | InChI=1S/C38H40N8O3/c39-37(31-5-1-3-17-43-31)45-25-7-9-29(35(23-25)47-27-13-19-41-20-14-27)33-11-12-34(49-33)30-10-8-26(46-38(40)32-6-2-4-18-44-32)24-36(30)48-28-15-21-42-22-16-28/h1-12,17-18,23-24,27-28,41-42H,13-16,19-22H2,(H2,39,45)(H2,40,46) |
| InChIKey | InChI | 1.03 | ZOPMAKJQIUYLIW-UHFFFAOYSA-N |
