Vitas-M small molecule compound
4-{[(E)-{3-[(3-bromophenoxy)methyl]-4-methoxyphenyl}methylidene]amino}-4H-1,2,4-triazole-3-thiol
Catalog ID
STK306381
SMILES COc1ccc(cc1COc1cccc(c1)Br)/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 C17H15BrN4O2S MW 419.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4O2S/c1-23-16-6-5-12(9-20-22-11-19-21-17(22)25)7-13(16)10-24-15-4-2-3-14(18)8-15/h2-9,11H,10H2,1H3,(H,21,25)/b20-9+InChIKey
FMJZHGPDNNHPCS-AWQFTUOYSA-NSynonyms
828278-85-94(((E)(3((3bromophenoxy)methyl)4methoxyphenyl)methylidene)amino)4H124triazole3thiol
4((E)(3((3bromophenoxy)methyl)4methoxyphenyl)methylideneamino)1H124triazole5thione
828278859
COC1=C(C=C(C=C1)C=NN2C=NNC2=S)COC3=CC(=CC=C3)Br
COc1ccc(cc1COc1cccc(c1)Br)C=Nn1cnnc1S
InChI=1SC17H15BrN4O2Sc123166512(9202211192117(22)25)713(16)10241542314(18)815h2911H10H21H3(H2125)b209+
MFCD04053760
ZINC000002790130
ZINC2790129
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