Vitas-M small molecule compound
2-{[4-ethyl-5-(7-methoxy-1-benzofuran-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-hydroxy-2,4-dimethoxyphenyl)ethanone
Catalog ID
STL182537
SMILES COc1ccc(c(c1O)OC)C(=O)CSc1nnc(n1CC)c1cc2c(o1)c(OC)ccc2
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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 C23H23N3O6S MW 469.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O6S/c1-5-26-22(18-11-13-7-6-8-17(30-3)20(13)32-18)24-25-23(26)33-12-15(27)14-9-10-16(29-2)19(28)21(14)31-4/h6-11,28H,5,12H2,1-4H3InChIKey
VWDIQIXJKVHBRP-UHFFFAOYSA-NSynonyms
2((4ethyl5(7methoxy1benzofuran2yl)124triazol3yl)sulfanyl)1(3hydroxy24dimethoxyphenyl)ethanone
2((4ethyl5(7methoxy1benzofuran2yl)4H124triazol3yl)sulfanyl)1(3hydroxy24dimethoxyphenyl)ethanone
CCN1C(=NN=C1SCC(=O)C2=C(C(=C(C=C2)OC)O)OC)C3=CC4=C(O3)C(=CC=C4)OC
InChI=1SC23H23N3O6Sc152622(18111376817(303)20(13)3218)242523(26)331215(27)1491016(292)19(28)21(14)314h61128H512H214H3
MFCD22125375
ZINC000072191447
ZINC72191447
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