Vitas-M small molecule compound
3-[4-chloro-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-1-{4-[(1-methyl-1H-pyrazol-4-yl)sulfonyl]piperazin-1-yl}propan-1-one
Catalog ID
STK310385
SMILES O=C(N1CCN(CC1)S(=O)(=O)c1cnn(c1)C)CCn1nc(c(c1C)Cl)C(F)(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 C16H20ClF3N6O3S MW 468.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20ClF3N6O3S/c1-11-14(17)15(16(18,19)20)22-26(11)4-3-13(27)24-5-7-25(8-6-24)30(28,29)12-9-21-23(2)10-12/h9-10H,3-8H2,1-2H3InChIKey
KTIJZQOFZGTFDC-UHFFFAOYSA-NSynonyms
1005638-20-91005638209
3(4chloro5methyl3(trifluoromethyl)1Hpyrazol1yl)1(4((1methyl1Hpyrazol4yl)sulfonyl)piperazin1yl)propan1one
3(4chloro5methyl3(trifluoromethyl)pyrazol1yl)1(4(1methylpyrazol4yl)sulfonylpiperazin1yl)propan1one
CC1=C(C(=NN1CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CN(N=C3)C)C(F)(F)F)Cl
InChI=1SC16H20ClF3N6O3Sc11114(17)15(16(1819)20)2226(11)4313(27)245725(8624)30(2829)1292123(2)1012h910H38H212H3
MFCD05667046
ZINC000002804932
ZINC02804932
ZINC2804932
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