Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C23H24N2O3S/c1-2-29-22-19-14-18(28-16-17-6-4-3-5-7-17)8-9-21(19)24-15-20(22)23(26)25-10-12-27-13-11-25/h3-9,14-15H,2,10-13,16H2,1H3 |
InChIKey | InChI | 1.03 | INDSTSRQMXNXSG-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCSc1c(cnc2ccc(OCc3ccccc3)cc12)C(=O)N4CCOCC4 |
SMILES | CACTVS | 3.385 | CCSc1c(cnc2ccc(OCc3ccccc3)cc12)C(=O)N4CCOCC4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCSc1c2cc(ccc2ncc1C(=O)N3CCOCC3)OCc4ccccc4 |
SMILES | OpenEye OEToolkits | 1.7.6 | CCSc1c2cc(ccc2ncc1C(=O)N3CCOCC3)OCc4ccccc4 |