Vitas-M small molecule compound
4-benzyl-5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK956296
SMILES Cc1nn(c(c1Cl)C)Cc1nnc(n1Cc1ccccc1)S
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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 C15H16ClN5S MW 333.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16ClN5S/c1-10-14(16)11(2)21(19-10)9-13-17-18-15(22)20(13)8-12-6-4-3-5-7-12/h3-7H,8-9H2,1-2H3,(H,18,22)InChIKey
OETBIAILIAEMEQ-UHFFFAOYSA-NSynonyms
512812-45-24BENZYL3((4CHLORO35DIMETHYLPYRAZOL1YL)METHYL)1H124TRIAZOLE5THIONE
4benzyl5((4chloro35dimethyl1Hpyrazol1yl)methyl)4H124triazole3thiol
512812452
CC1=C(C(=NN1CC2=NNC(=S)N2CC3=CC=CC=C3)C)Cl
InChI=1SC15H16ClN5Sc11014(16)11(2)21(1910)913171815(22)20(13)8126435712h37H89H212H3(H1822)
MFCD03075070
ZINC000013143609
ZINC13143609
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