| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | n2c1cc(ccc1nc2c4ccc(c3ccc(C(=[N@H])N)cc3O)cc4)C(=[N@H])N |
| InChI | InChI | 1.03 | InChI=1S/C21H18N6O/c22-19(23)13-6-8-16-17(9-13)27-21(26-16)12-3-1-11(2-4-12)15-7-5-14(20(24)25)10-18(15)28/h1-10,28H,(H3,22,23)(H3,24,25)(H,26,27) |
| InChIKey | InChI | 1.03 | VYJOWVQQJBILOA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | NC(=N)c1ccc(c(O)c1)c2ccc(cc2)c3[nH]c4ccc(cc4n3)C(N)=N |
| SMILES | CACTVS | 3.385 | NC(=N)c1ccc(c(O)c1)c2ccc(cc2)c3[nH]c4ccc(cc4n3)C(N)=N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | [H]/N=C(/c1ccc2c(c1)nc([nH]2)c3ccc(cc3)c4ccc(cc4O)/C(=N/[H])/N)\N |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1c2ccc(cc2O)C(=N)N)c3[nH]c4ccc(cc4n3)C(=N)N |
