Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | Clc1ccccc1N(C(=O)c3sc2c4ccccc4OCc2c3)C |
SMILES_CANONICAL | CACTVS | 3.370 | CN(C(=O)c1sc2c(COc3ccccc23)c1)c4ccccc4Cl |
SMILES | CACTVS | 3.370 | CN(C(=O)c1sc2c(COc3ccccc23)c1)c4ccccc4Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CN(c1ccccc1Cl)C(=O)c2cc3c(s2)-c4ccccc4OC3 |
SMILES | OpenEye OEToolkits | 1.7.0 | CN(c1ccccc1Cl)C(=O)c2cc3c(s2)-c4ccccc4OC3 |
InChI | InChI | 1.03 | InChI=1S/C19H14ClNO2S/c1-21(15-8-4-3-7-14(15)20)19(22)17-10-12-11-23-16-9-5-2-6-13(16)18(12)24-17/h2-10H,11H2,1H3 |
InChIKey | InChI | 1.03 | PCSYEOAUKWBYOX-UHFFFAOYSA-N |