| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | n2c1c(cc(OC)c(OC)c1)c(nc2)Nc3cccc(SC)c3 |
| SMILES_CANONICAL | CACTVS | 3.341 | COc1cc2ncnc(Nc3cccc(SC)c3)c2cc1OC |
| SMILES | CACTVS | 3.341 | COc1cc2ncnc(Nc3cccc(SC)c3)c2cc1OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COc1cc2c(cc1OC)ncnc2Nc3cccc(c3)SC |
| SMILES | OpenEye OEToolkits | 1.5.0 | COc1cc2c(cc1OC)ncnc2Nc3cccc(c3)SC |
| InChI | InChI | 1.03 | InChI=1S/C17H17N3O2S/c1-21-15-8-13-14(9-16(15)22-2)18-10-19-17(13)20-11-5-4-6-12(7-11)23-3/h4-10H,1-3H3,(H,18,19,20) |
| InChIKey | InChI | 1.03 | FUSDVOSGGMBSMK-UHFFFAOYSA-N |
