Vitas-M small molecule compound
{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}(phenyl)acetic acid
Catalog ID
STL099243
SMILES N#Cc1c(nc(cc1C(F)(F)F)C)SC(c1ccccc1)C(=O)O
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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 C16H11F3N2O2S MW 352.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11F3N2O2S/c1-9-7-12(16(17,18)19)11(8-20)14(21-9)24-13(15(22)23)10-5-3-2-4-6-10/h2-7,13H,1H3,(H,22,23)InChIKey
RPOJBRMBSZCPCZ-UHFFFAOYSA-NSynonyms
921072-49-3((3cyano6methyl4(trifluoromethyl)pyridin2yl)sulfanyl)(phenyl)aceticacid
2(3CYANO6METHYL4(TRIFLUOROMETHYL)(2PYRIDYLTHIO))2PHENYLACETICACID
2(3cyano6methyl4(trifluoromethyl)pyridin2yl)sulfanyl2phenylaceticacid
921072493
CC1=NC(=C(C(=C1)C(F)(F)F)C#N)SC(C2=CC=CC=C2)C(=O)O
InChI=1SC16H11F3N2O2Sc19712(16(1718)19)11(820)14(219)2413(15(22)23)105324610h2713H1H3(H2223)
MFCD18454054
ZINC000022866719
ZINC000022866725
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