Vitas-M small molecule compound

6-(3-tert-butyl-1-methyl-1H-pyrazol-5-yl)-3-(3,4-difluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STL247097
SMILES Fc1cc(ccc1F)c1nnc2n1nc(s2)c1cc(nn1C)C(C)(C)C

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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 C17H16F2N6S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16F2N6S/c1-17(2,3)13-8-12(24(4)22-13)15-23-25-14(20-21-16(25)26-15)9-5-6-10(18)11(19)7-9/h5-8H,1-4H3
InChIKey
MBJPLTWCKLTMAJ-UHFFFAOYSA-N
Synonyms
1324079-71-1
1324079711
6(3(tertbutyl)1methyl1Hpyrazol5yl)3(34difluorophenyl)(124)triazolo(34b)(134)thiadiazole
6(3tertbutyl1methyl1Hpyrazol5yl)3(34difluorophenyl)(124)triazolo(34b)(134)thiadiazole
6(5tertbutyl2methylpyrazol3yl)3(34difluorophenyl)(124)triazolo(34b)(134)thiadiazole
CC(C)(C)C1=NN(C(=C1)C2=NN3C(=NN=C3S2)C4=CC(=C(C=C4)F)F)C
InChI=1SC17H16F2N6Sc117(23)13812(24(4)2213)15232514(202116(25)2615)95610(18)11(19)79h58H14H3
MFCD19712542
ZINC000071287043
ZINC71287043

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Available files

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