Vitas-M small molecule compound
3-(ethylsulfanyl)-N-[(E)-{5-[(2,4,6-trichlorophenoxy)methyl]furan-2-yl}methylidene]-4H-1,2,4-triazol-4-amine
Catalog ID
STL173503
SMILES CCSc1nncn1/N=C/c1ccc(o1)COc1c(Cl)cc(cc1Cl)Cl
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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 C16H13Cl3N4O2S MW 431.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13Cl3N4O2S/c1-2-26-16-22-20-9-23(16)21-7-11-3-4-12(25-11)8-24-15-13(18)5-10(17)6-14(15)19/h3-7,9H,2,8H2,1H3/b21-7+InChIKey
HPVKWOCALIRKMB-QPSGOUHRSA-NSynonyms
866737-64-6(E)N(3ethylsulfanyl124triazol4yl)1(5((246trichlorophenoxy)methyl)furan2yl)methanimine
3(ethylsulfanyl)N((E)(5((246trichlorophenoxy)methyl)furan2yl)methylidene)4H124triazol4amine
866737646
CCSC1=NN=CN1N=CC2=CC=C(O2)COC3=C(C=C(C=C3Cl)Cl)Cl
CCSc1nncn1N=Cc1ccc(o1)COc1c(Cl)cc(cc1Cl)Cl
InChI=1SC16H13Cl3N4O2Sc1226162220923(16)217113412(2511)8241513(18)510(17)614(15)19h379H28H21H3b217+
MFCD07433954
ZINC000020617966
ZINC96577623
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