| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C(Cc1ccccc1SC)N1CCC2C(C2C1)C(N)=O |
| InChI | InChI | 1.06 | InChI=1S/C16H20N2O2S/c1-21-13-5-3-2-4-10(13)8-14(19)18-7-6-11-12(9-18)15(11)16(17)20/h2-5,11-12,15H,6-9H2,1H3,(H2,17,20)/t11-,12+,15+/m1/s1 |
| InChIKey | InChI | 1.06 | UZZFRRNYJXSFIQ-XUJVJEKNSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CSc1ccccc1CC(=O)N2CC[C@@H]3[C@H](C2)[C@H]3C(N)=O |
| SMILES | CACTVS | 3.385 | CSc1ccccc1CC(=O)N2CC[CH]3[CH](C2)[CH]3C(N)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | CSc1ccccc1CC(=O)N2CC[C@@H]3[C@H](C2)[C@H]3C(=O)N |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | CSc1ccccc1CC(=O)N2CCC3C(C2)C3C(=O)N |
