Vitas-M small molecule compound
1-(3,4-dimethoxyphenyl)-2-{[4-ethyl-5-(2-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Catalog ID
STK289082
SMILES COc1cc(ccc1OC)C(=O)CSc1nnc(n1CC)c1ccccc1C
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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 C21H23N3O3S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S/c1-5-24-20(16-9-7-6-8-14(16)2)22-23-21(24)28-13-17(25)15-10-11-18(26-3)19(12-15)27-4/h6-12H,5,13H2,1-4H3InChIKey
IJLUQBBYPOQWPP-UHFFFAOYSA-NSynonyms
1(34DIMETHOXYPHENYL)2((4ETHYL5(2METHYLPHENYL)124TRIAZOL3YL)SULFANYL)ETHANONE
1(34DIMETHOXYPHENYL)2((4ETHYL5(2METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)ETHANONE
CCN1C(=NN=C1SCC(=O)C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3C
InChI=1SC21H23N3O3Sc152420(16976814(16)2)222321(24)281317(25)15101118(263)19(1215)274h612H513H214H3
MFCD09039623
ZINC000007044016
ZINC07044016
ZINC7044016
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