Vitas-M small molecule compound
4-{[(E)-{3-[(4-ethylphenoxy)methyl]-4-methoxyphenyl}methylidene]amino}-4H-1,2,4-triazole-3-thiol
Catalog ID
STL177627
SMILES COc1ccc(cc1COc1ccc(cc1)CC)/C=N/n1cnnc1S
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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 C19H20N4O2S MW 368.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N4O2S/c1-3-14-4-7-17(8-5-14)25-12-16-10-15(6-9-18(16)24-2)11-21-23-13-20-22-19(23)26/h4-11,13H,3,12H2,1-2H3,(H,22,26)/b21-11+InChIKey
AJBHJJNCXWXQKK-SRZZPIQSSA-NSynonyms
4(((E)(3((4ethylphenoxy)methyl)4methoxyphenyl)methylidene)amino)4H124triazole3thiol
4((E)(3((4ethylphenoxy)methyl)4methoxyphenyl)methylideneamino)1H124triazole5thione
CCC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C=NN3C=NNC3=S)OC
COc1ccc(cc1COc1ccc(cc1)CC)C=Nn1cnnc1S
InChI=1SC19H20N4O2Sc13144717(8514)2512161015(6918(16)242)11212313202219(23)26h41113H312H212H3(H2226)b2111+
MFCD04053755
ZINC000008483651
ZINC2791561
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