Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-cyanophenyl)acetamide
Catalog ID
STL364386
SMILES N#Cc1ccccc1NC(=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 C21H17N5O2S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O2S/c1-2-26-20(18-11-14-7-4-6-10-17(14)28-18)24-25-21(26)29-13-19(27)23-16-9-5-3-8-15(16)12-22/h3-11H,2,13H2,1H3,(H,23,27)InChIKey
YNSZFQJZBGPIGJ-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4ethyl124triazol3yl)sulfanyl)N(2cyanophenyl)acetamide
2((5(1benzofuran2yl)4ethyl4H124triazol3yl)sulfanyl)N(2cyanophenyl)acetamide
CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C#N)C3=CC4=CC=CC=C4O3
InChI=1SC21H17N5O2Sc122620(1811147461017(14)2818)242521(26)291319(27)2316953815(16)1222h311H213H21H3(H2327)
MFCD09476517
ZINC000010136539
ZINC10136539
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