Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1N=C(NS(=O)(=O)c2cccc3ccccc32)S\C1=C/c1ccccc1Oc1ccccc1 |
InChI | InChI | 1.06 | InChI=1S/C26H18N2O4S2/c29-25-23(17-19-10-5-7-15-22(19)32-20-12-2-1-3-13-20)33-26(27-25)28-34(30,31)24-16-8-11-18-9-4-6-14-21(18)24/h1-17H,(H,27,28,29)/b23-17- |
InChIKey | InChI | 1.06 | KIEKSKXBVATTRQ-QJOMJCCJSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C/1N=C(N[S](=O)(=O)c2cccc3ccccc23)SC/1=C/c4ccccc4Oc5ccccc5 |
SMILES | CACTVS | 3.385 | O=C1N=C(N[S](=O)(=O)c2cccc3ccccc23)SC1=Cc4ccccc4Oc5ccccc5 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Oc2ccccc2/C=C\3/C(=O)N=C(S3)NS(=O)(=O)c4cccc5c4cccc5 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Oc2ccccc2C=C3C(=O)N=C(S3)NS(=O)(=O)c4cccc5c4cccc5 |