Vitas-M small molecule compound
2,4-dichloro-5-{[4-(ethylsulfonyl)piperazin-1-yl]sulfonyl}benzoic acid
Catalog ID
STL179021
SMILES CCS(=O)(=O)N1CCN(CC1)S(=O)(=O)c1cc(C(=O)O)c(cc1Cl)Cl
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C13H16Cl2N2O6S2 MW 431.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16Cl2N2O6S2/c1-2-24(20,21)16-3-5-17(6-4-16)25(22,23)12-7-9(13(18)19)10(14)8-11(12)15/h7-8H,2-6H2,1H3,(H,18,19)InChIKey
CUZFFPRMEXIMJO-UHFFFAOYSA-NSynonyms
938005-75-524dichloro5((4(ethylsulfonyl)piperazin1yl)sulfonyl)benzoicacid
24dichloro5(4ethylsulfonylpiperazin1yl)sulfonylbenzoicacid
938005755
CCS(=O)(=O)N1CCN(CC1)S(=O)(=O)C2=C(C=C(C(=C2)C(=O)O)Cl)Cl
InChI=1SC13H16Cl2N2O6S2c1224(2021)163517(6416)25(2223)1279(13(18)19)10(14)811(12)15h78H26H21H3(H1819)
MFCD08556736
ZINC000036615234
ZINC36615234
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