Vitas-M small molecule compound
4-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}benzoic acid
Catalog ID
STK539080
SMILES N#Cc1c(C)cc(nc1SCc1ccc(cc1)C(=O)O)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 C16H14N2O2S MW 298.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O2S/c1-10-7-11(2)18-15(14(10)8-17)21-9-12-3-5-13(6-4-12)16(19)20/h3-7H,9H2,1-2H3,(H,19,20)InChIKey
OEEKWSIWANIIHO-UHFFFAOYSA-NSynonyms
371225-75-1371225751
4(((3cyano46dimethylpyridin2yl)sulfanyl)methyl)benzoicacid
4(((3cyano46dimethylpyridin2yl)thio)methyl)benzoicacid
4((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYLMETHYL)BENZOICACID
4(3CYANO46DIMETHYLPYRIDIN2YLSULFANYLMETHYL)BENZOICACID
CC1=CC(=NC(=C1C#N)SCC2=CC=C(C=C2)C(=O)O)C
InChI=1SC16H14N2O2Sc110711(2)1815(14(10)817)219123513(6412)16(19)20h37H9H212H3(H1920)
MFCD02949145
ZINC000000547131
ZINC547131
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