Vitas-M small molecule compound
N-[(E)-{5-[(2,5-dichlorophenoxy)methyl]furan-2-yl}methylidene]-3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STK306303
SMILES CSc1nnc(n1/N=C/c1ccc(o1)COc1cc(Cl)ccc1Cl)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 C16H12Cl2F2N4O2S MW 433.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12Cl2F2N4O2S/c1-27-16-23-22-15(14(19)20)24(16)21-7-10-3-4-11(26-10)8-25-13-6-9(17)2-5-12(13)18/h2-7,14H,8H2,1H3/b21-7+InChIKey
APCMPYHQNMBVTN-QPSGOUHRSA-NSynonyms
828277-91-4(E)1(5((25dichlorophenoxy)methyl)furan2yl)N(3(difluoromethyl)5methylsulfanyl124triazol4yl)methanimine
828277914
CSC1=NN=C(N1N=CC2=CC=C(O2)COC3=C(C=CC(=C3)Cl)Cl)C(F)F
CSc1nnc(n1N=Cc1ccc(o1)COc1cc(Cl)ccc1Cl)C(F)F
InChI=1SC16H12Cl2F2N4O2Sc12716232215(14(19)20)24(16)217103411(2610)8251369(17)2512(13)18h2714H8H21H3b217+
MFCD04049714
N((E)(5((25dichlorophenoxy)methyl)furan2yl)methylidene)3(difluoromethyl)5(methylsulfanyl)4H124triazol4amine
ZINC000002789859
ZINC35678984
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