Vitas-M small molecule compound
2-{[5-(5-bromo-1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Catalog ID
STK218975
SMILES CCn1c(SCC(=O)c2ccccc2)nnc1c1cc2c(o1)ccc(c2)Br
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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 C20H16BrN3O2S MW 442.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrN3O2S/c1-2-24-19(18-11-14-10-15(21)8-9-17(14)26-18)22-23-20(24)27-12-16(25)13-6-4-3-5-7-13/h3-11H,2,12H2,1H3InChIKey
XNCAWHBAYZBTBT-UHFFFAOYSA-NSynonyms
2((5(5BROMANYL1BENZOFURAN2YL)4ETHYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5(5BROMO1BENZOFURAN2YL)4ETHYL124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5(5BROMO1BENZOFURAN2YL)4ETHYL4H124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((5(5BROMO1BENZOFURAN2YL)4ETHYL4H124TRIAZOL3YL)THIO)1PHENYLETHANONE
2((5(5BROMO2BENZOFURANYL)4ETHYL124TRIAZOL3YL)THIO)1PHENYLETHANONE
2((5(5BROMOBENZOFURAN2YL)4ETHYL124TRIAZOL3YL)THIO)1PHENYLETHANONE
CCN1C(=NN=C1SCC(=O)C2=CC=CC=C2)C3=CC4=C(O3)C=CC(=C4)Br
InChI=1SC20H16BrN3O2Sc122419(1811141015(21)8917(14)2618)222320(24)271216(25)136435713h311H212H21H3
MFCD06000658
ZINC000002868738
ZINC02868738
ZINC2868738
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