Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(=O)(c1ccc(OC)cc1)Nc2ccc3c(c2)N(C(=O)N3C)C |
InChI | InChI | 1.03 | InChI=1S/C16H17N3O4S/c1-18-14-9-4-11(10-15(14)19(2)16(18)20)17-24(21,22)13-7-5-12(23-3)6-8-13/h4-10,17H,1-3H3 |
InChIKey | InChI | 1.03 | CXVPOMVKVCGHLI-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1)[S](=O)(=O)Nc2ccc3N(C)C(=O)N(C)c3c2 |
SMILES | CACTVS | 3.385 | COc1ccc(cc1)[S](=O)(=O)Nc2ccc3N(C)C(=O)N(C)c3c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CN1c2ccc(cc2N(C1=O)C)NS(=O)(=O)c3ccc(cc3)OC |
SMILES | OpenEye OEToolkits | 1.9.2 | CN1c2ccc(cc2N(C1=O)C)NS(=O)(=O)c3ccc(cc3)OC |