Vitas-M small molecule compound
1-methyl-3-({1-[(4-methylphenyl)sulfonyl]piperidin-4-yl}carbamoyl)-1H-pyrazole-4-carboxylic acid
Catalog ID
STL395222
SMILES Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)NC(=O)c1nn(cc1C(=O)O)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 C18H22N4O5S MW 406.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O5S/c1-12-3-5-14(6-4-12)28(26,27)22-9-7-13(8-10-22)19-17(23)16-15(18(24)25)11-21(2)20-16/h3-6,11,13H,7-10H2,1-2H3,(H,19,23)(H,24,25)InChIKey
FKNMECMXHKQNJG-UHFFFAOYSA-NSynonyms
1174875-04-71174875047
1METHYL3((1((4METHYLPHENYL)SULFONYL)PIPERIDIN4YL)CARBAMOYL)1HPYRAZOLE4CARBOXYLICACID
1methyl3((1(4methylphenyl)sulfonylpiperidin4yl)carbamoyl)pyrazole4carboxylicacid
CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=NN(C=C3C(=O)O)C
InChI=1SC18H22N4O5Sc1123514(6412)28(2627)229713(81022)1917(23)1615(18(24)25)1121(2)2016h361113H710H212H3(H1923)(H2425)
MFCD09470315
ZINC000020614842
ZINC20614842
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