Vitas-M small molecule compound

1-{[1-(difluoromethyl)-1H-pyrazol-4-yl]sulfonyl}-4-(4-methoxybenzyl)piperazine

Catalog ID
STL404622
SMILES COc1ccc(cc1)CN1CCN(CC1)S(=O)(=O)c1cnn(c1)C(F)F

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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 C16H20F2N4O3S MW 386.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20F2N4O3S/c1-25-14-4-2-13(3-5-14)11-20-6-8-21(9-7-20)26(23,24)15-10-19-22(12-15)16(17)18/h2-5,10,12,16H,6-9,11H2,1H3
InChIKey
GRBAWRFHEYDXQC-UHFFFAOYSA-N
Synonyms
1006341-83-8
1((1(difluoromethyl)1Hpyrazol4yl)sulfonyl)4(4methoxybenzyl)piperazine
1(1(difluoromethyl)pyrazol4yl)sulfonyl4((4methoxyphenyl)methyl)piperazine
1006341838
COC1=CC=C(C=C1)CN2CCN(CC2)S(=O)(=O)C3=CN(N=C3)C(F)F
InChI=1SC16H20F2N4O3Sc125144213(3514)11206821(9720)26(2324)15101922(1215)16(17)18h25101216H6911H21H3
MFCD08556399
ZINC000036614859
ZINC36614859

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Available files

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