Vitas-M small molecule compound
4-[5-(4-methylphenyl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STK533075
SMILES OC(=O)CCC(=O)N1N=C(CC1c1ccc(cc1)C)c1cccs1
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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 C18H18N2O3S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3S/c1-12-4-6-13(7-5-12)15-11-14(16-3-2-10-24-16)19-20(15)17(21)8-9-18(22)23/h2-7,10,15H,8-9,11H2,1H3,(H,22,23)InChIKey
SLKYRQVJTUUSMY-UHFFFAOYSA-NSynonyms
4(3(4METHYLPHENYL)5THIOPHEN2YL34DIHYDROPYRAZOL2YL)4OXOBUTANOICACID
4(5(4methylphenyl)3(thiophen2yl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4oxo4(3(thiophen2yl)5(ptolyl)45dihydro1Hpyrazol1yl)butanoicacid
CC1=CC=C(C=C1)C2CC(=NN2C(=O)CCC(=O)O)C3=CC=CS3
InChI=1SC18H18N2O3Sc1124613(7512)151114(1632102416)1920(15)17(21)8918(22)23h271015H8911H21H3(H2223)
MFCD02216191
ZINC000004858071
ZINC000004858072
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