Vitas-M small molecule compound
3-(furan-2-yl)-5-(methylsulfanyl)-N-[(E)-{5-[(2,4,6-trichlorophenoxy)methyl]furan-2-yl}methylidene]-4H-1,2,4-triazol-4-amine
Catalog ID
STL173522
SMILES CSc1nnc(n1/N=C/c1ccc(o1)COc1c(Cl)cc(cc1Cl)Cl)c1ccco1
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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 C19H13Cl3N4O3S MW 483.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13Cl3N4O3S/c1-30-19-25-24-18(16-3-2-6-27-16)26(19)23-9-12-4-5-13(29-12)10-28-17-14(21)7-11(20)8-15(17)22/h2-9H,10H2,1H3/b23-9+InChIKey
GQTHTRNXNFZGCZ-NUGSKGIGSA-NSynonyms
866564-26-3(E)N(3(furan2yl)5methylsulfanyl124triazol4yl)1(5((246trichlorophenoxy)methyl)furan2yl)methanimine
3(furan2yl)5(methylsulfanyl)N((E)(5((246trichlorophenoxy)methyl)furan2yl)methylidene)4H124triazol4amine
866564263
CSC1=NN=C(N1N=CC2=CC=C(O2)COC3=C(C=C(C=C3Cl)Cl)Cl)C4=CC=CO4
CSc1nnc(n1N=Cc1ccc(o1)COc1c(Cl)cc(cc1Cl)Cl)c1ccco1
InChI=1SC19H13Cl3N4O3Sc13019252418(163262716)26(19)239124513(2912)10281714(21)711(20)815(17)22h29H10H21H3b239+
MFCD07433940
ZINC000036611335
ZINC96577150
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