Vitas-M small molecule compound
1-methyl-5-({4-[(4-methylphenyl)sulfonyl]piperazin-1-yl}carbonyl)-1H-pyrazole-4-carboxylic acid
Catalog ID
STL398887
SMILES O=C(c1n(C)ncc1C(=O)O)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C
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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 C17H20N4O5S MW 392.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N4O5S/c1-12-3-5-13(6-4-12)27(25,26)21-9-7-20(8-10-21)16(22)15-14(17(23)24)11-18-19(15)2/h3-6,11H,7-10H2,1-2H3,(H,23,24)InChIKey
RDMBOCJWSIPUBW-UHFFFAOYSA-NSynonyms
1174865-08-71174865087
1METHYL5((4((4METHYLPHENYL)SULFONYL)PIPERAZIN1YL)CARBONYL)1HPYRAZOLE4CARBOXYLICACID
1methyl5(4(4methylphenyl)sulfonylpiperazine1carbonyl)pyrazole4carboxylicacid
CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=NN3C)C(=O)O
InChI=1SC17H20N4O5Sc1123513(6412)27(2526)219720(81021)16(22)1514(17(23)24)111819(15)2h3611H710H212H3(H2324)
MFCD09470522
ZINC000020614655
ZINC20614655
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