| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)c2sc(cc2N(C(=O)C1CCC(C)CC1)C(C)C)c3ccccc3 |
| SMILES_CANONICAL | CACTVS | 3.341 | CC(C)N(C(=O)[C@H]1CC[C@H](C)CC1)c2cc(sc2C(O)=O)c3ccccc3 |
| SMILES | CACTVS | 3.341 | CC(C)N(C(=O)[CH]1CC[CH](C)CC1)c2cc(sc2C(O)=O)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1CCC(CC1)C(=O)N(c2cc(sc2C(=O)O)c3ccccc3)C(C)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1CCC(CC1)C(=O)N(c2cc(sc2C(=O)O)c3ccccc3)C(C)C |
| InChI | InChI | 1.03 | InChI=1S/C22H27NO3S/c1-14(2)23(21(24)17-11-9-15(3)10-12-17)18-13-19(27-20(18)22(25)26)16-7-5-4-6-8-16/h4-8,13-15,17H,9-12H2,1-3H3,(H,25,26)/t15-,17- |
| InChIKey | InChI | 1.03 | RZXQBIKGWSLVEK-JCNLHEQBSA-N |
