Vitas-M small molecule compound
2-{[5-(5-bromo-1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(methylsulfanyl)phenyl]acetamide
Catalog ID
STK151541
SMILES CSc1cccc(c1)NC(=O)CSc1nnc(n1CC)c1cc2c(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 C21H19BrN4O2S2 MW 503.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN4O2S2/c1-3-26-20(18-10-13-9-14(22)7-8-17(13)28-18)24-25-21(26)30-12-19(27)23-15-5-4-6-16(11-15)29-2/h4-11H,3,12H2,1-2H3,(H,23,27)InChIKey
GRWIMBLZJLVYRV-UHFFFAOYSA-NSynonyms
2((5(5BROMO1BENZOFURAN2YL)4ETHYL124TRIAZOL3YL)SULFANYL)N(3METHYLSULFANYLPHENYL)ACETAMIDE
2((5(5BROMO1BENZOFURAN2YL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(3(METHYLSULFANYL)PHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)SC)C3=CC4=C(O3)C=CC(=C4)Br
InChI=1SC21H19BrN4O2S2c132620(181013914(22)7817(13)2818)242521(26)301219(27)231554616(1115)292h411H312H212H3(H2327)
MFCD04387100
ZINC000002859311
ZINC02859311
ZINC2859311
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