Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-ethoxyphenyl)acetamide
Catalog ID
STL364249
SMILES CCOc1ccc(cc1)NC(=O)CSc1nnc(n1C)c1cc2c(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 C21H20N4O3S MW 408.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3S/c1-3-27-16-10-8-15(9-11-16)22-19(26)13-29-21-24-23-20(25(21)2)18-12-14-6-4-5-7-17(14)28-18/h4-12H,3,13H2,1-2H3,(H,22,26)InChIKey
ZJKQTPBZXXFYMW-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4methyl124triazol3yl)sulfanyl)N(4ethoxyphenyl)acetamide
2((5(1benzofuran2yl)4methyl4H124triazol3yl)sulfanyl)N(4ethoxyphenyl)acetamide
CCOC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC4=CC=CC=C4O3
InChI=1SC21H20N4O3Sc13271610815(91116)2219(26)132921242320(25(21)2)181214645717(14)2818h412H313H212H3(H2226)
MFCD04389077
ZINC000006355241
ZINC06355241
ZINC6355241
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