| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(c1ncn(c1)C(CO)CCc2ccccc2)N |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(=O)c1cn(cn1)[C@@H](CO)CCc2ccccc2 |
| SMILES | CACTVS | 3.341 | NC(=O)c1cn(cn1)[CH](CO)CCc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CC[C@H](CO)n2cc(nc2)C(=O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc(cc1)CCC(CO)n2cc(nc2)C(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C14H17N3O2/c15-14(19)13-8-17(10-16-13)12(9-18)7-6-11-4-2-1-3-5-11/h1-5,8,10,12,18H,6-7,9H2,(H2,15,19)/t12-/m1/s1 |
| InChIKey | InChI | 1.03 | ZUYUIKKHHBEVHL-GFCCVEGCSA-N |
