Vitas-M small molecule compound
5-[(4-chlorophenoxy)methyl]-4-(2-methoxyphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK891275
SMILES COc1ccccc1n1c(COc2ccc(cc2)Cl)nnc1S
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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 C16H14ClN3O2S MW 347.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14ClN3O2S/c1-21-14-5-3-2-4-13(14)20-15(18-19-16(20)23)10-22-12-8-6-11(17)7-9-12/h2-9H,10H2,1H3,(H,19,23)InChIKey
DRAFCTNBTZMTHA-UHFFFAOYSA-NSynonyms
3((4chlorophenoxy)methyl)4(2methoxyphenyl)1H124triazole5thione
5((4chlorophenoxy)methyl)4(2methoxyphenyl)4H124triazole3thiol
COC1=CC=CC=C1N2C(=NNC2=S)COC3=CC=C(C=C3)Cl
InChI=1SC16H14ClN3O2Sc12114532413(14)2015(181916(20)23)1022128611(17)7912h29H10H21H3(H1923)
MFCD08690839
ZINC000011692622
ZINC11692622
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