Vitas-M small molecule compound
N-[(E)-{5-[(2-chloro-6-methylphenoxy)methyl]furan-2-yl}methylidene]-3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL177329
SMILES CSc1nnc(n1/N=C/c1ccc(o1)COc1c(C)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 C17H15ClF2N4O2S MW 412.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15ClF2N4O2S/c1-10-4-3-5-13(18)14(10)25-9-12-7-6-11(26-12)8-21-24-16(15(19)20)22-23-17(24)27-2/h3-8,15H,9H2,1-2H3/b21-8+InChIKey
QJODQOZHBFEGNV-ODCIPOBUSA-NSynonyms
828288-06-8(E)1(5((2chloro6methylphenoxy)methyl)furan2yl)N(3(difluoromethyl)5methylsulfanyl124triazol4yl)methanimine
828288068
CC1=C(C(=CC=C1)Cl)OCC2=CC=C(O2)C=NN3C(=NN=C3SC)C(F)F
CSc1nnc(n1N=Cc1ccc(o1)COc1c(C)cccc1Cl)C(F)F
InChI=1SC17H15ClF2N4O2Sc11043513(18)14(10)259127611(2612)8212416(15(19)20)222317(24)272h3815H9H212H3b218+
MFCD04052783
N((E)(5((2chloro6methylphenoxy)methyl)furan2yl)methylidene)3(difluoromethyl)5(methylsulfanyl)4H124triazol4amine
ZINC000002792672
ZINC2792671
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