Vitas-M small molecule compound
2-{[4-(furan-2-ylmethyl)-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[3-(trifluoromethyl)phenyl]acetamide
Catalog ID
STL341673
SMILES O=C(Nc1cccc(c1)C(F)(F)F)CSc1nnc(n1Cc1ccco1)c1cccnc1
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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 C21H16F3N5O2S MW 459.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F3N5O2S/c22-21(23,24)15-5-1-6-16(10-15)26-18(30)13-32-20-28-27-19(14-4-2-8-25-11-14)29(20)12-17-7-3-9-31-17/h1-11H,12-13H2,(H,26,30)InChIKey
MKHULRPHRGEIQL-UHFFFAOYSA-NSynonyms
578700-40-02((4(furan2ylmethyl)5(pyridin3yl)4H124triazol3yl)sulfanyl)N(3(trifluoromethyl)phenyl)acetamide
2((4(furan2ylmethyl)5(pyridin3yl)4H124triazol3yl)thio)N(3(trifluoromethyl)phenyl)acetamide
2((4(FURAN2YLMETHYL)5PYRIDIN3YL124TRIAZOL3YL)SULFANYL)N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
2(4(2FURYLMETHYL)5(3PYRIDYL)(124TRIAZOL3YLTHIO))N(3(TRIFLUOROMETHYL)PHENYL)ACETAMIDE
578700400
C1=CC(=CC(=C1)NC(=O)CSC2=NN=C(N2CC3=CC=CO3)C4=CN=CC=C4)C(F)(F)F
InChI=1SC21H16F3N5O2Sc2221(2324)1551616(1015)2618(30)133220282719(14428251114)29(20)12177393117h111H1213H2(H2630)
MFCD04029281
ZINC000002386988
ZINC02386988
ZINC2386988
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