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| IUPAC Name: | 3-chloro-2,4-dimethylbenzenesulfonyl chloride |
| Description: | 3-Chloro-2,4-dimethyl-benzenesulfonyl Chloride is an intermediate in the synthesis of 3-Chloro-Vortioxetine (C424140) which is an impurity of Vortioxetine (V766000), a multimodal serotonergic agent. Vortioxetine inhibits 5-HT1A, 5-HT1B, 5-HT3A, 5-HT7 receptor and SERT. |
| Molecular Weight: | 239.12 |
| Molecular Formula: | C8H8Cl2O2S |
| Canonical SMILES: | CC1=C(C(=C(C=C1)S(=O)(=O)Cl)C)Cl |
| InChI: | InChI=1S/C8H8Cl2O2S/c1-5-3-4-7(13(10,11)12)6(2)8(5)9/h3-4H,1-2H3 |
| InChI Key: | AECHXMDEQIWQAW-UHFFFAOYSA-N |
| Solubility: | Ethylacetate |
| Appearance: | White Solid |
| Storage: | -20°C Freezer |
| References: | Bang-Andersen, B., et al. J. Med. Chem., 54, 3206 (2011); Mørk, A., et al. J. Pharmacol. Exp. Ther., 340, 666 (2012); Mørk, A., et al. Pharmacol. Biochem. Behav. 105C, 41 (2013). |
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