Vitas-M small molecule compound
2-[(5-{[(4-chlorobenzyl)sulfanyl]methyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methylphenyl)acetamide
Catalog ID
STK144781
SMILES CCn1c(SCC(=O)Nc2ccc(cc2)C)nnc1CSCc1ccc(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 C21H23ClN4OS2 MW 447.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN4OS2/c1-3-26-19(13-28-12-16-6-8-17(22)9-7-16)24-25-21(26)29-14-20(27)23-18-10-4-15(2)5-11-18/h4-11H,3,12-14H2,1-2H3,(H,23,27)InChIKey
CQXPRXRZKIXAEX-UHFFFAOYSA-NSynonyms
2((5(((4CHLOROBENZYL)SULFANYL)METHYL)4ETHYL4H124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
2((5((4CHLOROPHENYL)METHYLSULFANYLMETHYL)4ETHYL124TRIAZOL3YL)SULFANYL)N(4METHYLPHENYL)ACETAMIDE
CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C)CSCC3=CC=C(C=C3)Cl
InChI=1SC21H23ClN4OS2c132619(132812166817(22)9716)242521(26)291420(27)231810415(2)51118h411H31214H212H3(H2327)
MFCD08671455
ZINC000013880431
ZINC13880431
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