Vitas-M small molecule compound
3-(difluoromethyl)-N-[(E)-{5-[(2-methylphenoxy)methyl]furan-2-yl}methylidene]-5-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STK307031
SMILES CSc1nnc(n1/N=C/c1ccc(o1)COc1ccccc1C)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 C17H16F2N4O2S MW 378.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F2N4O2S/c1-11-5-3-4-6-14(11)24-10-13-8-7-12(25-13)9-20-23-16(15(18)19)21-22-17(23)26-2/h3-9,15H,10H2,1-2H3/b20-9+InChIKey
VLSPQHPADJQKQV-AWQFTUOYSA-NSynonyms
828287-35-0(E)N(3(difluoromethyl)5methylsulfanyl124triazol4yl)1(5((2methylphenoxy)methyl)furan2yl)methanimine
3(difluoromethyl)N((E)(5((2methylphenoxy)methyl)furan2yl)methylidene)5(methylsulfanyl)4H124triazol4amine
828287350
CC1=CC=CC=C1OCC2=CC=C(O2)C=NN3C(=NN=C3SC)C(F)F
CSc1nnc(n1N=Cc1ccc(o1)COc1ccccc1C)C(F)F
InChI=1SC17H16F2N4O2Sc111534614(11)2410138712(2513)9202316(15(18)19)212217(23)262h3915H10H212H3b209+
MFCD05666930
ZINC000002792488
ZINC2792487
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