Vitas-M small molecule compound
4-[5-(2-methoxyphenyl)-3-{2-[(methylsulfonyl)amino]phenyl}-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STK739609
SMILES COc1ccccc1C1CC(=NN1C(=O)CCC(=O)O)c1ccccc1NS(=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 C21H23N3O6S MW 445.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O6S/c1-30-19-10-6-4-8-15(19)18-13-17(22-24(18)20(25)11-12-21(26)27)14-7-3-5-9-16(14)23-31(2,28)29/h3-10,18,23H,11-13H2,1-2H3,(H,26,27)InChIKey
XSVKSSFUIFEXDZ-UHFFFAOYSA-NSynonyms
920453-15-24(5(2(methanesulfonamido)phenyl)3(2methoxyphenyl)34dihydropyrazol2yl)4oxobutanoicacid
4(5(2METHOXYPHENYL)3(2((METHYLSULFONYL)AMINO)PHENYL)(2PYRAZOLINYL))4OXOBUTANOICACID
4(5(2methoxyphenyl)3(2((methylsulfonyl)amino)phenyl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4(5(2METHOXYPHENYL)3(2(METHYLSULFONAMIDO)PHENYL)45DIHYDRO1HPYRAZOL1YL)4OXOBUTANOICACID
920453152
COC1=CC=CC=C1C2CC(=NN2C(=O)CCC(=O)O)C3=CC=CC=C3NS(=O)(=O)C
InChI=1SC21H23N3O6Sc130191064815(19)181317(2224(18)20(25)111221(26)27)14735916(14)2331(228)29h3101823H1113H212H3(H2627)
MFCD08542070
ZINC000009060542
ZINC000009060543
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