Vitas-M small molecule compound
N-[(E)-{5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}methylidene]-3-(ethylsulfanyl)-5-(trifluoromethyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173341
SMILES CCSc1nnc(n1/N=C/c1ccc(o1)COc1c(C)cccc1Cl)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 C18H16ClF3N4O2S MW 444.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClF3N4O2S/c1-3-29-17-25-24-16(18(20,21)22)26(17)23-9-12-7-8-13(28-12)10-27-15-11(2)5-4-6-14(15)19/h4-9H,3,10H2,1-2H3/b23-9+InChIKey
WLRHMCNOPGIQAT-NUGSKGIGSA-NSynonyms
866742-70-3(E)1(5((2chloro6methylphenoxy)methyl)furan2yl)N(3ethylsulfanyl5(trifluoromethyl)124triazol4yl)methanimine
866742703
CCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=C(C=CC=C3Cl)C)C(F)(F)F
CCSc1nnc(n1N=Cc1ccc(o1)COc1c(C)cccc1Cl)C(F)(F)F
InChI=1SC18H16ClF3N4O2Sc132917252416(18(2021)22)26(17)239127813(2812)10271511(2)54614(15)19h49H310H212H3b239+
MFCD06196094
N((E)(5((2chloro6methylphenoxy)methyl)furan2yl)methylidene)3(ethylsulfanyl)5(trifluoromethyl)4H124triazol4amine
ZINC000020617947
ZINC96577615
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