Vitas-M small molecule compound
1-({5-[(4-chlorophenoxy)methyl]-4-ethyl-4H-1,2,4-triazol-3-yl}sulfanyl)-3,3-dimethylbutan-2-one
Catalog ID
STK567670
SMILES CCn1c(COc2ccc(cc2)Cl)nnc1SCC(=O)C(C)(C)C
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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 C17H22ClN3O2S MW 367.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22ClN3O2S/c1-5-21-15(10-23-13-8-6-12(18)7-9-13)19-20-16(21)24-11-14(22)17(2,3)4/h6-9H,5,10-11H2,1-4H3InChIKey
NBYSETBZEAPMFK-UHFFFAOYSA-NSynonyms
849030-69-91((5((4CHLOROPHENOXY)METHYL)4ETHYL124TRIAZOL3YL)SULFANYL)33DIMETHYLBUTAN2ONE
1((5((4chlorophenoxy)methyl)4ethyl4H124triazol3yl)sulfanyl)33dimethylbutan2one
1((5((4chlorophenoxy)methyl)4ethyl4H124triazol3yl)thio)33dimethylbutan2one
1(5((4CHLOROPHENOXY)METHYL)4ETHYL(124TRIAZOL3YLTHIO))33DIMETHYLBUTAN2ONE
849030699
CCN1C(=NN=C1SCC(=O)C(C)(C)C)COC2=CC=C(C=C2)Cl
InChI=1SC17H22ClN3O2Sc152115(1023138612(18)7913)192016(21)241114(22)17(23)4h69H51011H214H3
MFCD05681853
ZINC000002454189
ZINC02454189
ZINC2454189
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