Vitas-M small molecule compound

tert-butyl 4-{[1-(difluoromethyl)-5-methyl-1H-pyrazol-4-yl]sulfonyl}piperazine-1-carboxylate

Catalog ID
STL399702
SMILES FC(n1ncc(c1C)S(=O)(=O)N1CCN(CC1)C(=O)OC(C)(C)C)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 C14H22F2N4O4S MW 380.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H22F2N4O4S/c1-10-11(9-17-20(10)12(15)16)25(22,23)19-7-5-18(6-8-19)13(21)24-14(2,3)4/h9,12H,5-8H2,1-4H3
InChIKey
KZNXSCCSSNUXGC-UHFFFAOYSA-N
Synonyms
1006351-79-6
1006351796
CC1=C(C=NN1C(F)F)S(=O)(=O)N2CCN(CC2)C(=O)OC(C)(C)C
InChI=1SC14H22F2N4O4Sc11011(91720(10)12(15)16)25(2223)197518(6819)13(21)2414(23)4h912H58H214H3
MFCD08555893
TERTBUTYL4((1(DIFLUOROMETHYL)5METHYL1HPYRAZOL4YL)SULFONYL)PIPERAZINE1CARBOXYLATE
tertbutyl4(1(difluoromethyl)5methylpyrazol4yl)sulfonylpiperazine1carboxylate
ZINC000036614456
ZINC36614456

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Available files

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