Vitas-M small molecule compound
4-benzyl-5-[2-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STK302219
SMILES Cc1nn(c(c1Br)C)CCc1nnc(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 C16H18BrN5S MW 392.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18BrN5S/c1-11-15(17)12(2)22(20-11)9-8-14-18-19-16(23)21(14)10-13-6-4-3-5-7-13/h3-7H,8-10H2,1-2H3,(H,19,23)InChIKey
JZSNIUWVQMVWFS-UHFFFAOYSA-NSynonyms
512816-77-24BENZYL3(2(4BROMO35DIMETHYLPYRAZOL1YL)ETHYL)1H124TRIAZOLE5THIONE
4benzyl5(2(4bromo35dimethyl1Hpyrazol1yl)ethyl)4H124triazole3thiol
512816772
CC1=C(C(=NN1CCC2=NNC(=S)N2CC3=CC=CC=C3)C)Br
InChI=1SC16H18BrN5Sc11115(17)12(2)22(2011)9814181916(23)21(14)10136435713h37H810H212H3(H1923)
MFCD03467721
ZINC000005433624
ZINC5433624
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