Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(=O)(N)c2ccc(NC(=O)Nc1ccccc1C(C)C)cc2 |
SMILES_CANONICAL | CACTVS | 3.370 | CC(C)c1ccccc1NC(=O)Nc2ccc(cc2)[S](N)(=O)=O |
SMILES | CACTVS | 3.370 | CC(C)c1ccccc1NC(=O)Nc2ccc(cc2)[S](N)(=O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CC(C)c1ccccc1NC(=O)Nc2ccc(cc2)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 1.7.0 | CC(C)c1ccccc1NC(=O)Nc2ccc(cc2)S(=O)(=O)N |
InChI | InChI | 1.03 | InChI=1S/C16H19N3O3S/c1-11(2)14-5-3-4-6-15(14)19-16(20)18-12-7-9-13(10-8-12)23(17,21)22/h3-11H,1-2H3,(H2,17,21,22)(H2,18,19,20) |
InChIKey | InChI | 1.03 | NCAVVYYIUQIEED-UHFFFAOYSA-N |