Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-chloro-3-methylphenyl)acetamide
Catalog ID
STL365046
SMILES CCn1c(SCC(=O)Nc2ccc(c(c2)C)Cl)nnc1c1cc2c(o1)cccc2
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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 C21H19ClN4O2S MW 426.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClN4O2S/c1-3-26-20(18-11-14-6-4-5-7-17(14)28-18)24-25-21(26)29-12-19(27)23-15-8-9-16(22)13(2)10-15/h4-11H,3,12H2,1-2H3,(H,23,27)InChIKey
IVDWDUWUDPVGFY-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4ethyl124triazol3yl)sulfanyl)N(4chloro3methylphenyl)acetamide
2((5(1benzofuran2yl)4ethyl4H124triazol3yl)sulfanyl)N(4chloro3methylphenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC(=C(C=C2)Cl)C)C3=CC4=CC=CC=C4O3
InChI=1SC21H19ClN4O2Sc132620(181114645717(14)2818)242521(26)291219(27)23158916(22)13(2)1015h411H312H212H3(H2327)
MFCD09216126
ZINC000010675267
ZINC10675267
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