Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(piperidin-1-yl)ethanone
Catalog ID
STL364403
SMILES O=C(N1CCCCC1)CSc1nnc(n1C)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 C18H20N4O2S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O2S/c1-21-17(15-11-13-7-3-4-8-14(13)24-15)19-20-18(21)25-12-16(23)22-9-5-2-6-10-22/h3-4,7-8,11H,2,5-6,9-10,12H2,1H3InChIKey
QLDKFEHBCAMTPE-UHFFFAOYSA-NSynonyms
2((5(1benzofuran2yl)4methyl124triazol3yl)sulfanyl)1piperidin1ylethanone
2((5(1benzofuran2yl)4methyl4H124triazol3yl)sulfanyl)1(piperidin1yl)ethanone
CN1C(=NN=C1SCC(=O)N2CCCCC2)C3=CC4=CC=CC=C4O3
InChI=1SC18H20N4O2Sc12117(151113734814(13)2415)192018(21)251216(23)2295261022h347811H25691012H21H3
MFCD09175009
ZINC000010478234
ZINC10478234
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