Vitas-M small molecule compound

3-(4-fluorophenyl)-6-(1H-pyrazol-1-ylmethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK937582
SMILES Fc1ccc(cc1)c1nnc2n1nc(s2)Cn1cccn1

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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 C13H9FN6S MW 300.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9FN6S/c14-10-4-2-9(3-5-10)12-16-17-13-20(12)18-11(21-13)8-19-7-1-6-15-19/h1-7H,8H2
InChIKey
CZTOZXMMOUULRK-UHFFFAOYSA-N
Synonyms
1219583-39-7
1219583397
3(4fluorophenyl)6(1Hpyrazol1ylmethyl)(124)triazolo(34b)(134)thiadiazole
3(4fluorophenyl)6(pyrazol1ylmethyl)(124)triazolo(34b)(134)thiadiazole
6((1Hpyrazol1yl)methyl)3(4fluorophenyl)(124)triazolo(34b)(134)thiadiazole
C1=CN(N=C1)CC2=NN3C(=NN=C3S2)C4=CC=C(C=C4)F
InChI=1SC13H9FN6Sc1410429(3510)1216171320(12)1811(2113)8197161519h17H8H2
MFCD16627341
ZINC000040287797
ZINC40287797

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.