Vitas-M small molecule compound
3-[(4-chlorobenzyl)sulfanyl]-5-[3-(4-chloro-2-methylphenoxy)propyl]-4-ethyl-4H-1,2,4-triazole
Catalog ID
STK472998
SMILES CCn1c(CCCOc2ccc(cc2C)Cl)nnc1SCc1ccc(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 C21H23Cl2N3OS MW 436.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23Cl2N3OS/c1-3-26-20(5-4-12-27-19-11-10-18(23)13-15(19)2)24-25-21(26)28-14-16-6-8-17(22)9-7-16/h6-11,13H,3-5,12,14H2,1-2H3InChIKey
VTSYRSJPZOJQKO-UHFFFAOYSA-NSynonyms
3((4chlorobenzyl)sulfanyl)5(3(4chloro2methylphenoxy)propyl)4ethyl4H124triazole
3(3(4chloro2methylphenoxy)propyl)5((4chlorophenyl)methylsulfanyl)4ethyl124triazole
4CHLORO1(3(5((4CHLOROPHENYL)METHYLTHIO)4ETHYL(124TRIAZOL3YL))PROPOXY)2METHYLBENZENE
CCN1C(=NN=C1SCC2=CC=C(C=C2)Cl)CCCOC3=C(C=C(C=C3)Cl)C
InChI=1SC21H23Cl2N3OSc132620(54122719111018(23)1315(19)2)242521(26)2814166817(22)9716h61113H351214H212H3
MFCD07080368
ZINC000017100046
ZINC17100046
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