Vitas-M small molecule compound
N-[(E)-{5-[(2,6-dichlorophenoxy)methyl]furan-2-yl}methylidene]-3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173323
SMILES CCSc1nnc(n1/N=C/c1ccc(o1)COc1c(Cl)cccc1Cl)C(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 C17H14Cl2F2N4O2S MW 447.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl2F2N4O2S/c1-2-28-17-24-23-16(15(20)21)25(17)22-8-10-6-7-11(27-10)9-26-14-12(18)4-3-5-13(14)19/h3-8,15H,2,9H2,1H3/b22-8+InChIKey
DVBGUJIQDKOKGR-GZIVZEMBSA-NSynonyms
866737-72-6(E)1(5((26dichlorophenoxy)methyl)furan2yl)N(3(difluoromethyl)5ethylsulfanyl124triazol4yl)methanimine
866737726
CCSC1=NN=C(N1N=CC2=CC=C(O2)COC3=C(C=CC=C3Cl)Cl)C(F)F
CCSc1nnc(n1N=Cc1ccc(o1)COc1c(Cl)cccc1Cl)C(F)F
InChI=1SC17H14Cl2F2N4O2Sc122817242316(15(20)21)25(17)228106711(2710)9261412(18)43513(14)19h3815H29H21H3b228+
MFCD06195938
N((E)(5((26dichlorophenoxy)methyl)furan2yl)methylidene)3(difluoromethyl)5(ethylsulfanyl)4H124triazol4amine
ZINC000036611384
ZINC96576976
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