Vitas-M small molecule compound
2-{[4-methyl-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-phenylethanone
Catalog ID
STK187013
SMILES O=C(c1ccccc1)CSc1nnc(n1C)COc1ccccc1
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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 C18H17N3O2S MW 339.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O2S/c1-21-17(12-23-15-10-6-3-7-11-15)19-20-18(21)24-13-16(22)14-8-4-2-5-9-14/h2-11H,12-13H2,1H3InChIKey
AJGKAKVJXCKZHC-UHFFFAOYSA-NSynonyms
2((4METHYL5(PHENOXYMETHYL)124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2((4METHYL5(PHENOXYMETHYL)4H124TRIAZOL3YL)SULFANYL)1PHENYLETHANONE
2(4METHYL5(PHENOXYMETHYL)(124TRIAZOL3YLTHIO))1PHENYLETHAN1ONE
2(4METHYL5PHENOXYMETHYL4H(124)TRIAZOL3YLSULFANYL)1PHENYLETHANONE
CN1C(=NN=C1SCC(=O)C2=CC=CC=C2)COC3=CC=CC=C3
InChI=1SC18H17N3O2Sc12117(122315106371115)192018(21)241316(22)148425914h211H1213H21H3
MFCD03051048
ZINC000000420605
ZINC00420605
ZINC420605
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