Vitas-M small molecule compound
3-[(4-methylphenoxy)methyl]-4-(prop-2-en-1-yl)-5-{[3-(trifluoromethyl)benzyl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STL056280
SMILES C=CCn1c(COc2ccc(cc2)C)nnc1SCc1cccc(c1)C(F)(F)F
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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 C21H20F3N3OS MW 419.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N3OS/c1-3-11-27-19(13-28-18-9-7-15(2)8-10-18)25-26-20(27)29-14-16-5-4-6-17(12-16)21(22,23)24/h3-10,12H,1,11,13-14H2,2H3InChIKey
NQPBRZBZZUDMIC-UHFFFAOYSA-NSynonyms
861148-04-13((4methylphenoxy)methyl)4(prop2en1yl)5((3(trifluoromethyl)benzyl)sulfanyl)4H124triazole
3((4METHYLPHENOXY)METHYL)4PROP2ENYL5((3(TRIFLUOROMETHYL)PHENYL)METHYLSULFANYL)124TRIAZOLE
3(4METHYLPHENOXYMETHYL)4(PROP2EN1YL)5(((3(TRIFLUOROMETHYL)PHENYL)METHYL)SULFANYL)4H124TRIAZOLE
4allyl3((ptolyloxy)methyl)5((3(trifluoromethyl)benzyl)thio)4H124triazole
4METHYL1((4PROP2ENYL5((3(TRIFLUOROMETHYL)PHENYL)METHYLTHIO)(124TRIAZOL3YL))METHOXY)BENZENE
861148041
CC1=CC=C(C=C1)OCC2=NN=C(N2CC=C)SCC3=CC(=CC=C3)C(F)(F)F
InChI=1SC21H20F3N3OSc13112719(1328189715(2)81018)252620(27)29141654617(1216)21(2223)24h31012H1111314H22H3
MFCD05684351
ZINC000005478304
ZINC05478304
ZINC5478304
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