Vitas-M small molecule compound
2-{[4-ethyl-5-(2-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(3-hydroxy-2,4-dimethoxyphenyl)ethanone
Catalog ID
STL182542
SMILES COc1ccc(c(c1O)OC)C(=O)CSc1nnc(n1CC)c1ccccc1OC
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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 C21H23N3O5S MW 429.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O5S/c1-5-24-20(14-8-6-7-9-16(14)27-2)22-23-21(24)30-12-15(25)13-10-11-17(28-3)18(26)19(13)29-4/h6-11,26H,5,12H2,1-4H3InChIKey
HKOPFLPUZXNTRV-UHFFFAOYSA-NSynonyms
2((4ethyl5(2methoxyphenyl)124triazol3yl)sulfanyl)1(3hydroxy24dimethoxyphenyl)ethanone
2((4ethyl5(2methoxyphenyl)4H124triazol3yl)sulfanyl)1(3hydroxy24dimethoxyphenyl)ethanone
CCN1C(=NN=C1SCC(=O)C2=C(C(=C(C=C2)OC)O)OC)C3=CC=CC=C3OC
InChI=1SC21H23N3O5Sc152420(14867916(14)272)222321(24)301215(25)13101117(283)18(26)19(13)294h61126H512H214H3
MFCD22125381
ZINC000072191453
ZINC72191453
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