Vitas-M small molecule compound
2-{2-[(2,6-dichlorobenzyl)sulfanyl]-1,3-benzothiazol-6-yl}hexahydro-1H-isoindole-1,3(2H)-dione
Catalog ID
STK761831
SMILES O=C1N(c2ccc3c(c2)sc(n3)SCc2c(Cl)cccc2Cl)C(=O)C2C1CCCC2
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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 C22H18Cl2N2O2S2 MW 477.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Cl2N2O2S2/c23-16-6-3-7-17(24)15(16)11-29-22-25-18-9-8-12(10-19(18)30-22)26-20(27)13-4-1-2-5-14(13)21(26)28/h3,6-10,13-14H,1-2,4-5,11H2InChIKey
XEFUOTZBTJLWHM-UHFFFAOYSA-NSynonyms
2(2((26dichlorobenzyl)sulfanyl)13benzothiazol6yl)hexahydro1Hisoindole13(2H)dione
2(2((26dichlorophenyl)methylsulfanyl)13benzothiazol6yl)3a45677ahexahydroisoindole13dione
C1CCC2C(C1)C(=O)N(C2=O)C3=CC4=C(C=C3)N=C(S4)SCC5=C(C=CC=C5Cl)Cl
InChI=1SC22H18Cl2N2O2S2c231663717(24)15(16)11292225189812(1019(18)3022)2620(27)13412514(13)21(26)28h36101314H124511H2
MFCD01871190
ZINC000012428394
ZINC000100086051
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