Vitas-M small molecule compound
4-(2-methylphenyl)-5-[(phenylamino)methyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL301476
SMILES Cc1ccccc1n1c(CNc2ccccc2)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 C16H16N4S MW 296.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4S/c1-12-7-5-6-10-14(12)20-15(18-19-16(20)21)11-17-13-8-3-2-4-9-13/h2-10,17H,11H2,1H3,(H,19,21)InChIKey
ABKHNYIGZJHKKL-UHFFFAOYSA-NSynonyms
3(anilinomethyl)4(2methylphenyl)1H124triazole5thione
4(2methylphenyl)5((phenylamino)methyl)4H124triazole3thiol
CC1=CC=CC=C1N2C(=NNC2=S)CNC3=CC=CC=C3
InChI=1SC16H16N4Sc1127561014(12)2015(181916(20)21)1117138324913h21017H11H21H3(H1921)
MFCD08690818
ZINC000026439329
ZINC26439329
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