Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide
Catalog ID
STL364255
SMILES COc1cccc(c1)NC(=O)CSc1nnc(n1CC)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/c1-3-25-20(18-11-14-7-4-5-10-17(14)28-18)23-24-21(25)29-13-19(26)22-15-8-6-9-16(12-15)27-2/h4-12H,3,13H2,1-2H3,(H,22,26)InChIKey
HDLNWNZPWYZZLQ-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4ethyl124triazol3yl)sulfanyl)N(3methoxyphenyl)acetamide
2((5(1benzofuran2yl)4ethyl4H124triazol3yl)sulfanyl)N(3methoxyphenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC(=CC=C2)OC)C3=CC4=CC=CC=C4O3
InChI=1SC21H20N4O3Sc132520(1811147451017(14)2818)232421(25)291319(26)221586916(1215)272h412H313H212H3(H2226)
MFCD04379347
ZINC000006356606
ZINC06356606
ZINC6356606
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