| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1C=C(N=C(N)N1C)C4CC4c3cccc(c2cccc(OC)c2)c3 |
| InChI | InChI | 1.03 | InChI=1S/C21H21N3O2/c1-24-20(25)12-19(23-21(24)22)18-11-17(18)15-7-3-5-13(9-15)14-6-4-8-16(10-14)26-2/h3-10,12,17-18H,11H2,1-2H3,(H2,22,23)/t17-,18-/m0/s1 |
| InChIKey | InChI | 1.03 | QECXNBWGUGUPSI-ROUUACIJSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | COc1cccc(c1)c2cccc(c2)[C@@H]3C[C@@H]3C4=CC(=O)N(C)C(=N4)N |
| SMILES | CACTVS | 3.370 | COc1cccc(c1)c2cccc(c2)[CH]3C[CH]3C4=CC(=O)N(C)C(=N4)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CN1C(=O)C=C(N=C1N)[C@H]2C[C@H]2c3cccc(c3)c4cccc(c4)OC |
| SMILES | OpenEye OEToolkits | 1.7.6 | CN1C(=O)C=C(N=C1N)C2CC2c3cccc(c3)c4cccc(c4)OC |
