| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(CC1(CSC)CC1)N1CCCC(C1)C(N)=O |
| InChI | InChI | 1.06 | InChI=1S/C13H22N2O2S/c1-18-9-13(4-5-13)7-11(16)15-6-2-3-10(8-15)12(14)17/h10H,2-9H2,1H3,(H2,14,17)/t10-/m0/s1 |
| InChIKey | InChI | 1.06 | HUXPZZDRMFMXBF-JTQLQIEISA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CSCC1(CC1)CC(=O)N2CCC[C@@H](C2)C(N)=O |
| SMILES | CACTVS | 3.385 | CSCC1(CC1)CC(=O)N2CCC[CH](C2)C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CSCC1(CC1)CC(=O)N2CCC[C@@H](C2)C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CSCC1(CC1)CC(=O)N2CCCC(C2)C(=O)N |
