| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(O)c3sc(c1cc(ccc1)NC2CC(C)(C)CC(C)(C)C2)c(Br)c3OCC(=O)O |
| SMILES_CANONICAL | CACTVS | 3.341 | CC1(C)CC(CC(C)(C)C1)Nc2cccc(c2)c3sc(C(O)=O)c(OCC(O)=O)c3Br |
| SMILES | CACTVS | 3.341 | CC1(C)CC(CC(C)(C)C1)Nc2cccc(c2)c3sc(C(O)=O)c(OCC(O)=O)c3Br |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CC1(CC(CC(C1)(C)C)Nc2cccc(c2)c3c(c(c(s3)C(=O)O)OCC(=O)O)Br)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CC1(CC(CC(C1)(C)C)Nc2cccc(c2)c3c(c(c(s3)C(=O)O)OCC(=O)O)Br)C |
| InChI | InChI | 1.03 | InChI=1S/C23H28BrNO5S/c1-22(2)9-15(10-23(3,4)12-22)25-14-7-5-6-13(8-14)19-17(24)18(30-11-16(26)27)20(31-19)21(28)29/h5-8,15,25H,9-12H2,1-4H3,(H,26,27)(H,28,29) |
| InChIKey | InChI | 1.03 | OSQARHVGUZHHGT-UHFFFAOYSA-N |
