Vitas-M small molecule compound
4-(3-methoxyphenyl)-5-[(phenylamino)methyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL301668
SMILES COc1cccc(c1)n1c(nnc1S)CNc1ccccc1
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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 C16H16N4OS MW 312.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4OS/c1-21-14-9-5-8-13(10-14)20-15(18-19-16(20)22)11-17-12-6-3-2-4-7-12/h2-10,17H,11H2,1H3,(H,19,22)InChIKey
ROICSKBNXCGNGJ-UHFFFAOYSA-NSynonyms
3(anilinomethyl)4(3methoxyphenyl)1H124triazole5thione
4(3methoxyphenyl)5((phenylamino)methyl)4H124triazole3thiol
COC1=CC=CC(=C1)N2C(=NNC2=S)CNC3=CC=CC=C3
InChI=1SC16H16N4OSc1211495813(1014)2015(181916(20)22)1117126324712h21017H11H21H3(H1922)
MFCD08690863
ZINC000026439431
ZINC26439431
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