Vitas-M small molecule compound
2-{[5-(3,6-dichloro-1-benzothiophen-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(2,4-dichlorophenyl)ethanone
Catalog ID
STK807252
SMILES CCn1c(SCC(=O)c2ccc(cc2Cl)Cl)nnc1c1sc2c(c1Cl)ccc(c2)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 C20H13Cl4N3OS2 MW 517.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13Cl4N3OS2/c1-2-27-19(18-17(24)13-6-4-11(22)8-16(13)30-18)25-26-20(27)29-9-15(28)12-5-3-10(21)7-14(12)23/h3-8H,2,9H2,1H3InChIKey
IFELABFLVQFPFI-UHFFFAOYSA-NSynonyms
2((5(36DICHLORO1BENZOTHIOPHEN2YL)4ETHYL124TRIAZOL3YL)SULFANYL)1(24DICHLOROPHENYL)ETHANONE
2((5(36dichloro1benzothiophen2yl)4ethyl4H124triazol3yl)sulfanyl)1(24dichlorophenyl)ethanone
2(5(36DICHLOROBENZO(B)THIOPHEN2YL)4ETHYL(124TRIAZOL3YLTHIO))1(24DICHLOROPHENYL)ETHAN1ONE
CCN1C(=NN=C1SCC(=O)C2=C(C=C(C=C2)Cl)Cl)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl
InChI=1SC20H13Cl4N3OS2c122719(1817(24)136411(22)816(13)3018)252620(27)29915(28)125310(21)714(12)23h38H29H21H3
MFCD05717281
ZINC000002695686
ZINC2695686
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