Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Cc1nc(NC(=O)C)sc1S(=O)(=O)Nc1cc(C#N)c(C)cc1 |
InChI | InChI | 1.06 | InChI=1S/C14H14N4O3S2/c1-8-4-5-12(6-11(8)7-15)18-23(20,21)13-9(2)16-14(22-13)17-10(3)19/h4-6,18H,1-3H3,(H,16,17,19) |
InChIKey | InChI | 1.06 | BORZWBYDXGSJEW-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Nc1sc(c(C)n1)[S](=O)(=O)Nc2ccc(C)c(c2)C#N |
SMILES | CACTVS | 3.385 | CC(=O)Nc1sc(c(C)n1)[S](=O)(=O)Nc2ccc(C)c(c2)C#N |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1C#N)NS(=O)(=O)c2c(nc(s2)NC(=O)C)C |
SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(cc1C#N)NS(=O)(=O)c2c(nc(s2)NC(=O)C)C |