Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(butan-2-yl)acetamide
Catalog ID
STL365107
SMILES CCC(NC(=O)CSc1nnc(n1CC)c1cc2c(o1)cccc2)C
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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 C18H22N4O2S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O2S/c1-4-12(3)19-16(23)11-25-18-21-20-17(22(18)5-2)15-10-13-8-6-7-9-14(13)24-15/h6-10,12H,4-5,11H2,1-3H3,(H,19,23)InChIKey
IMPOZKFZDQSXSF-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4ethyl124triazol3yl)sulfanyl)Nbutan2ylacetamide
2((5(1benzofuran2yl)4ethyl4H124triazol3yl)sulfanyl)N(butan2yl)acetamide
CCC(C)NC(=O)CSC1=NN=C(N1CC)C2=CC3=CC=CC=C3O2
InChI=1SC18H22N4O2Sc1412(3)1916(23)112518212017(22(18)52)151013867914(13)2415h61012H4511H213H3(H1923)
MFCD09217114
ZINC000010681959
ZINC000010681963
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