| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)CC(\C=C\C(=O)N)=C(\C(=O)O)Nc2c(cc1ccccn12)C=O |
| SMILES_CANONICAL | CACTVS | 3.341 | NC(=O)\C=C\C(C[SH](=O)=O)=C(\Nc1n2ccccc2cc1C=O)C(O)=O |
| SMILES | CACTVS | 3.341 | NC(=O)C=CC(C[SH](=O)=O)=C(Nc1n2ccccc2cc1C=O)C(O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccn2c(c1)cc(c2N/C(=C(\CS(=O)=O)/C=CC(=O)N)/C(=O)O)C=O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccn2c(c1)cc(c2NC(=C(CS(=O)=O)C=CC(=O)N)C(=O)O)C=O |
| InChI | InChI | 1.03 | InChI=1S/C16H15N3O6S/c17-13(21)5-4-10(9-26(24)25)14(16(22)23)18-15-11(8-20)7-12-3-1-2-6-19(12)15/h1-8,18,26H,9H2,(H2,17,21)(H,22,23)/b5-4+,14-10- |
| InChIKey | InChI | 1.03 | ARSFRLAHCNFFCE-IBXIYJDRSA-N |
