Vitas-M small molecule compound
2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL026074
SMILES C=CCn1c(SCC(=O)Nc2cccc(c2)C(F)(F)F)nnc1c1cccc(c1)OC
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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 C21H19F3N4O2S MW 448.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19F3N4O2S/c1-3-10-28-19(14-6-4-9-17(11-14)30-2)26-27-20(28)31-13-18(29)25-16-8-5-7-15(12-16)21(22,23)24/h3-9,11-12H,1,10,13H2,2H3,(H,25,29)InChIKey
UJQCGYXLCKQDFB-UHFFFAOYSA-NSynonyms
861644-91-92((4allyl5(3methoxyphenyl)4H124triazol3yl)thio)N(3(trifluoromethyl)phenyl)acetamide
2((5(3methoxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
2((5(3METHOXYPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(5(3METHOXYPHENYL)4PROP2ENYL(124TRIAZOL3YLTHIO))N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
861644919
COC1=CC=CC(=C1)C2=NN=C(N2CC=C)SCC(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC21H19F3N4O2Sc13102819(1464917(1114)302)262720(28)311318(29)251685715(1216)21(2223)24h391112H11013H22H3(H2529)
MFCD05686135
ZINC000009480302
ZINC09480302
ZINC9480302
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