Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cyclohexyl-N-methylacetamide
Catalog ID
STL122971
SMILES CCn1c(SCC(=O)N(C2CCCCC2)C)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 C21H26N4O2S MW 398.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O2S/c1-3-25-20(18-13-15-9-7-8-12-17(15)27-18)22-23-21(25)28-14-19(26)24(2)16-10-5-4-6-11-16/h7-9,12-13,16H,3-6,10-11,14H2,1-2H3InChIKey
MVPQKYAMEDDZIX-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4ethyl124triazol3yl)sulfanyl)NcyclohexylNmethylacetamide
2((5(1benzofuran2yl)4ethyl4H124triazol3yl)sulfanyl)NcyclohexylNmethylacetamide
CCN1C(=NN=C1SCC(=O)N(C)C2CCCCC2)C3=CC4=CC=CC=C4O3
InChI=1SC21H26N4O2Sc132520(1813159781217(15)2718)222321(25)281419(26)24(2)16105461116h79121316H36101114H212H3
MFCD09218572
ZINC000010860891
ZINC10860891
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