Vitas-M small molecule compound
4-(4-methoxyphenyl)-5-(2-phenylethyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STL381302
SMILES COc1ccc(cc1)n1c(nnc1S)CCc1ccccc1
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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 C17H17N3OS MW 311.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N3OS/c1-21-15-10-8-14(9-11-15)20-16(18-19-17(20)22)12-7-13-5-3-2-4-6-13/h2-6,8-11H,7,12H2,1H3,(H,19,22)InChIKey
CKVDIMZPHXNJCK-UHFFFAOYSA-NSynonyms
4(4methoxyphenyl)3(2phenylethyl)1H124triazole5thione
4(4METHOXYPHENYL)3PHENETHYL1H124TRIAZOLE5THIONE
4(4methoxyphenyl)5(2phenylethyl)4H124triazole3thiol
COC1=CC=C(C=C1)N2C(=NNC2=S)CCC3=CC=CC=C3
InChI=1SC17H17N3OSc1211510814(91115)2016(181917(20)22)127135324613h26811H712H21H3(H1922)
MFCD05134127
ZINC000005911019
ZINC05911019
ZINC5911019
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