Vitas-M small molecule compound
2-{[5-(5-bromo-1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Catalog ID
STK139621
SMILES O=C(CSc1nnc(n1C)c1cc2c(o1)ccc(c2)Br)NCCc1ccccc1
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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 C21H19BrN4O2S MW 471.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrN4O2S/c1-26-20(18-12-15-11-16(22)7-8-17(15)28-18)24-25-21(26)29-13-19(27)23-10-9-14-5-3-2-4-6-14/h2-8,11-12H,9-10,13H2,1H3,(H,23,27)InChIKey
JVPGWDDGDJBMFC-UHFFFAOYSA-NSynonyms
2((5(5bromo1benzofuran2yl)4methyl124triazol3yl)sulfanyl)N(2phenylethyl)acetamide
2((5(5BROMO1BENZOFURAN2YL)4METHYL124TRIAZOL3YL)SULFANYL)NPHENETHYLACETAMIDE
2((5(5BROMO1BENZOFURAN2YL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(2PHENYLETHYL)ACETAMIDE
CN1C(=NN=C1SCC(=O)NCCC2=CC=CC=C2)C3=CC4=C(O3)C=CC(=C4)Br
InChI=1SC21H19BrN4O2Sc12620(1812151116(22)7817(15)2818)242521(26)291319(27)23109145324614h281112H91013H21H3(H2327)
MFCD04395474
ZINC000000633946
ZINC00633946
ZINC633946
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