| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1ccc(nc1)C(=O)Nc2cccc(c2)C3(N=C(N)CN(C3=O)C)C |
| InChI | InChI | 1.03 | InChI=1S/C18H18ClN5O2/c1-18(17(26)24(2)10-15(20)23-18)11-4-3-5-13(8-11)22-16(25)14-7-6-12(19)9-21-14/h3-9H,10H2,1-2H3,(H2,20,23)(H,22,25)/t18-/m1/s1 |
| InChIKey | InChI | 1.03 | MRYFMHAPTQCQLE-GOSISDBHSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | CN1CC(=N[C@@](C)(C1=O)c2cccc(NC(=O)c3ccc(Cl)cn3)c2)N |
| SMILES | CACTVS | 3.370 | CN1CC(=N[C](C)(C1=O)c2cccc(NC(=O)c3ccc(Cl)cn3)c2)N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | C[C@]1(C(=O)N(CC(=N1)N)C)c2cccc(c2)NC(=O)c3ccc(cn3)Cl |
| SMILES | OpenEye OEToolkits | 1.7.2 | CC1(C(=O)N(CC(=N1)N)C)c2cccc(c2)NC(=O)c3ccc(cn3)Cl |
