| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c1sc(nc1N)NC/C=C)c3cc2ccccc2cc3 |
| SMILES_CANONICAL | CACTVS | 3.370 | Nc1nc(NCC=C)sc1C(=O)c2ccc3ccccc3c2 |
| SMILES | CACTVS | 3.370 | Nc1nc(NCC=C)sc1C(=O)c2ccc3ccccc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C=CCNc1nc(c(s1)C(=O)c2ccc3ccccc3c2)N |
| SMILES | OpenEye OEToolkits | 1.7.0 | C=CCNc1nc(c(s1)C(=O)c2ccc3ccccc3c2)N |
| InChI | InChI | 1.03 | InChI=1S/C17H15N3OS/c1-2-9-19-17-20-16(18)15(22-17)14(21)13-8-7-11-5-3-4-6-12(11)10-13/h2-8,10H,1,9,18H2,(H,19,20) |
| InChIKey | InChI | 1.03 | NWVQKPQYUAHOFK-UHFFFAOYSA-N |
