Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1N=C(NS(=O)(=O)c2cc3ccccc3cc2)S\C1=C/c1ccccc1Oc1ccccc1 |
InChI | InChI | 1.06 | InChI=1S/C26H18N2O4S2/c29-25-24(17-20-10-6-7-13-23(20)32-21-11-2-1-3-12-21)33-26(27-25)28-34(30,31)22-15-14-18-8-4-5-9-19(18)16-22/h1-17H,(H,27,28,29)/b24-17- |
InChIKey | InChI | 1.06 | UIPSKQQKIPOXRV-ULJHMMPZSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C/1N=C(N[S](=O)(=O)c2ccc3ccccc3c2)SC/1=C/c4ccccc4Oc5ccccc5 |
SMILES | CACTVS | 3.385 | O=C1N=C(N[S](=O)(=O)c2ccc3ccccc3c2)SC1=Cc4ccccc4Oc5ccccc5 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Oc2ccccc2/C=C\3/C(=O)N=C(S3)NS(=O)(=O)c4ccc5ccccc5c4 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)Oc2ccccc2C=C3C(=O)N=C(S3)NS(=O)(=O)c4ccc5ccccc5c4 |