Vitas-M small molecule compound
ethyl 5-{[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl}-1H-pyrazole-4-carboxylate
Catalog ID
STL104202
SMILES CCOC(=O)c1cn[nH]c1S(=O)(=O)N1CCN(CC1)c1ccccc1F
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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 C16H19FN4O4S MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19FN4O4S/c1-2-25-16(22)12-11-18-19-15(12)26(23,24)21-9-7-20(8-10-21)14-6-4-3-5-13(14)17/h3-6,11H,2,7-10H2,1H3,(H,18,19)InChIKey
JQEOJNBQEDDTMY-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(NN=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3F
CCOC(=O)c1cn(nH)c1S(=O)(=O)N1CCN(CC1)c1ccccc1F
ethyl5((4(2fluorophenyl)piperazin1yl)sulfonyl)1Hpyrazole4carboxylate
ethyl5(4(2fluorophenyl)piperazin1yl)sulfonyl1Hpyrazole4carboxylate
InChI=1SC16H19FN4O4Sc122516(22)1211181915(12)26(2324)219720(81021)14643513(14)17h3611H2710H21H3(H1819)
MFCD11994793
ZINC000017306794
ZINC17306794
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