Vitas-M small molecule compound
N-{(E)-[4-(difluoromethoxy)-3-ethoxyphenyl]methylidene}-3-(methylsulfanyl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL173460
SMILES CCOc1cc(ccc1OC(F)F)/C=N/n1cnnc1SC
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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 C13H14F2N4O2S MW 328.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14F2N4O2S/c1-3-20-11-6-9(4-5-10(11)21-12(14)15)7-17-19-8-16-18-13(19)22-2/h4-8,12H,3H2,1-2H3/b17-7+InChIKey
XFNKBSIPYXBEFW-REZTVBANSA-NSynonyms
866737-84-0(E)1(4(difluoromethoxy)3ethoxyphenyl)N(3methylsulfanyl124triazol4yl)methanimine
866737840
CCOC1=C(C=CC(=C1)C=NN2C=NN=C2SC)OC(F)F
CCOc1cc(ccc1OC(F)F)C=Nn1cnnc1SC
InChI=1SC13H14F2N4O2Sc13201169(4510(11)2112(14)15)717198161813(19)222h4812H3H212H3b177+
MFCD06195940
N((E)(4(difluoromethoxy)3ethoxyphenyl)methylidene)3(methylsulfanyl)4H124triazol4amine
ZINC000036611385
ZINC96569232
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