| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | N#Cc4c3nc(n(c1sc(cc1)C(=O)NC2CC2)c3ccc4)C |
| InChI | InChI | 1.03 | InChI=1S/C17H14N4OS/c1-10-19-16-11(9-18)3-2-4-13(16)21(10)15-8-7-14(23-15)17(22)20-12-5-6-12/h2-4,7-8,12H,5-6H2,1H3,(H,20,22) |
| InChIKey | InChI | 1.03 | XRXYHTFKWSMTFI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1nc2c(cccc2n1c3sc(cc3)C(=O)NC4CC4)C#N |
| SMILES | CACTVS | 3.385 | Cc1nc2c(cccc2n1c3sc(cc3)C(=O)NC4CC4)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1nc2c(cccc2n1c3ccc(s3)C(=O)NC4CC4)C#N |
| SMILES | OpenEye OEToolkits | 1.7.6 | Cc1nc2c(cccc2n1c3ccc(s3)C(=O)NC4CC4)C#N |
