Vitas-M small molecule compound

1-{[1-(difluoromethyl)-3-methyl-1H-pyrazol-4-yl]sulfonyl}-4-(3-fluorobenzyl)piperazine

Catalog ID
STL404987
SMILES Fc1cccc(c1)CN1CCN(CC1)S(=O)(=O)c1cn(nc1C)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 C16H19F3N4O2S MW 388.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19F3N4O2S/c1-12-15(11-23(20-12)16(18)19)26(24,25)22-7-5-21(6-8-22)10-13-3-2-4-14(17)9-13/h2-4,9,11,16H,5-8,10H2,1H3
InChIKey
DQGUQTHNGVHPIC-UHFFFAOYSA-N
Synonyms
1006337-51-4
1((1(difluoromethyl)3methyl1Hpyrazol4yl)sulfonyl)4(3fluorobenzyl)piperazine
1(1(difluoromethyl)3methylpyrazol4yl)sulfonyl4((3fluorophenyl)methyl)piperazine
1006337514
CC1=NN(C=C1S(=O)(=O)N2CCN(CC2)CC3=CC(=CC=C3)F)C(F)F
InChI=1SC16H19F3N4O2Sc11215(1123(2012)16(18)19)26(2425)227521(6822)101332414(17)913h2491116H5810H21H3
MFCD08556407
ZINC000036614869
ZINC36614869

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Available files

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