Vitas-M small molecule compound
2-{[5-(1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[2-(trifluoromethyl)phenyl]acetamide
Catalog ID
STK245648
SMILES C=CCn1c(SCC(=O)Nc2ccccc2C(F)(F)F)nnc1c1cc2c(o1)cccc2
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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 C22H17F3N4O2S MW 458.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17F3N4O2S/c1-2-11-29-20(18-12-14-7-3-6-10-17(14)31-18)27-28-21(29)32-13-19(30)26-16-9-5-4-8-15(16)22(23,24)25/h2-10,12H,1,11,13H2,(H,26,30)InChIKey
FHSICIXVTGSOQO-UHFFFAOYSA-NSynonyms
2((5(1BENZOFURAN2YL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(2(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2((5(1benzofuran2yl)4prop2enyl124triazol3yl)sulfanyl)N(2(trifluoromethyl)phenyl)acetamide
2(4ALLYL5BENZOFURAN2YL4H(124)TRIAZOL3YLSULFANYL)N(2TRIFLUOROMETHYLPHENYL)ACETAMIDE
C=CCN1C(=NN=C1SCC(=O)NC2=CC=CC=C2C(F)(F)F)C3=CC4=CC=CC=C4O3
InChI=1SC22H17F3N4O2Sc12112920(1812147361017(14)3118)272821(29)321319(30)2616954815(16)22(2324)25h21012H11113H2(H2630)
MFCD08670297
ZINC000009327739
ZINC09327739
ZINC9327739
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