Vitas-M small molecule compound
1-({5-[(4-chlorophenoxy)methyl]-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl}sulfanyl)-3,3-dimethylbutan-2-one
Catalog ID
STL040873
SMILES COc1ccc(cc1)n1c(nnc1SCC(=O)C(C)(C)C)COc1ccc(cc1)Cl
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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 C22H24ClN3O3S MW 445.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN3O3S/c1-22(2,3)19(27)14-30-21-25-24-20(13-29-18-9-5-15(23)6-10-18)26(21)16-7-11-17(28-4)12-8-16/h5-12H,13-14H2,1-4H3InChIKey
UKHBDLCVRAPRNL-UHFFFAOYSA-NSynonyms
861633-63-81((5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)33DIMETHYLBUTAN2ONE
1((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)33dimethylbutan2one
1((5((4chlorophenoxy)methyl)4(4methoxyphenyl)4H124triazol3yl)thio)33dimethylbutan2one
1(5((4CHLOROPHENOXY)METHYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))33DIMETHYLBUTAN2ONE
861633638
CC(C)(C)C(=O)CSC1=NN=C(N1C2=CC=C(C=C2)OC)COC3=CC=C(C=C3)Cl
InChI=1SC22H24ClN3O3Sc122(23)19(27)143021252420(1329189515(23)61018)26(21)1671117(284)12816h512H1314H214H3
MFCD05685054
ZINC000009309003
ZINC09309003
ZINC9309003
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