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-(2-methylcyclohexyl)acetamide
Catalog ID
STL370289
SMILES C=CCn1c(SCC(=O)NC2CCCCC2C)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 C22H26N4O2S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S/c1-3-12-26-21(19-13-16-9-5-7-11-18(16)28-19)24-25-22(26)29-14-20(27)23-17-10-6-4-8-15(17)2/h3,5,7,9,11,13,15,17H,1,4,6,8,10,12,14H2,2H3,(H,23,27)InChIKey
JYHLPZISHSGVEE-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(2methylcyclohexyl)acetamide
2((5(1benzofuran2yl)4prop2enyl124triazol3yl)sulfanyl)N(2methylcyclohexyl)acetamide
CC1CCCCC1NC(=O)CSC2=NN=C(N2CC=C)C3=CC4=CC=CC=C4O3
InChI=1SC22H26N4O2Sc13122621(1913169571118(16)2819)242522(26)291420(27)23171064815(17)2h357911131517H1468101214H22H3(H2327)
MFCD14279720
ZINC000015019327
ZINC000015019330
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