Vitas-M small molecule compound
3-(5-chloro-2-methoxyphenyl)-4-methyl-5-[({2-[3-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)sulfanyl]-4H-1,2,4-triazole
Catalog ID
STK474033
SMILES COc1ccc(cc1c1nnc(n1C)SCc1csc(n1)c1cccc(c1)C(F)(F)F)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 C21H16ClF3N4OS2 MW 496.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClF3N4OS2/c1-29-18(16-9-14(22)6-7-17(16)30-2)27-28-20(29)32-11-15-10-31-19(26-15)12-4-3-5-13(8-12)21(23,24)25/h3-10H,11H2,1-2H3InChIKey
BJVHWMDWCIKAFS-UHFFFAOYSA-NSynonyms
3(5chloro2methoxyphenyl)4methyl5(((2(3(trifluoromethyl)phenyl)13thiazol4yl)methyl)sulfanyl)4H124triazole
4((5(5chloro2methoxyphenyl)4methyl124triazol3yl)sulfanylmethyl)2(3(trifluoromethyl)phenyl)13thiazole
4CHLORO1METHOXY2(4METHYL5((2(3(TRIFLUOROMETHYL)PHENYL)(13THIAZOL4YL))METHYLTHIO)(124TRIAZOL3YL))BENZENE
CN1C(=NN=C1SCC2=CSC(=N2)C3=CC(=CC=C3)C(F)(F)F)C4=C(C=CC(=C4)Cl)OC
InChI=1SC21H16ClF3N4OS2c12918(16914(22)6717(16)302)272820(29)321115103119(2615)1243513(812)21(2324)25h310H11H212H3
MFCD07612673
ZINC000020427883
ZINC20427883
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