Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(pyridin-3-yl)acetamide
Catalog ID
STL193971
SMILES C=CCn1c(SCC(=O)Nc2cccnc2)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 C20H17N5O2S MW 391.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5O2S/c1-2-10-25-19(17-11-14-6-3-4-8-16(14)27-17)23-24-20(25)28-13-18(26)22-15-7-5-9-21-12-15/h2-9,11-12H,1,10,13H2,(H,22,26)InChIKey
YVLMKGXMTKNRQQ-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(pyridin3yl)acetamide
2((5(1benzofuran2yl)4prop2enyl124triazol3yl)sulfanyl)Npyridin3ylacetamide
C=CCN1C(=NN=C1SCC(=O)NC2=CN=CC=C2)C3=CC4=CC=CC=C4O3
InChI=1SC20H17N5O2Sc12102519(171114634816(14)2717)232420(25)281318(26)2215759211215h291112H11013H2(H2226)
MFCD22125376
ZINC000039750381
ZINC39750381
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