Vitas-M small molecule compound
4-[3-(4-methylphenyl)-5-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STL337547
SMILES OC(=O)CCC(=O)N1N=C(CC1c1cccs1)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 C18H18N2O3S MW 342.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3S/c1-12-4-6-13(7-5-12)14-11-15(16-3-2-10-24-16)20(19-14)17(21)8-9-18(22)23/h2-7,10,15H,8-9,11H2,1H3,(H,22,23)InChIKey
OLDALRBCNWTBHP-UHFFFAOYSA-NSynonyms
799794-51-74(3(4methylphenyl)5(thiophen2yl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4(3(4METHYLPHENYL)5THIOPHEN2YL45DIHYDRO1HPYRAZOL1YL)4OXOBUTANOICACID
4(5(4METHYLPHENYL)3THIOPHEN2YL34DIHYDROPYRAZOL2YL)4OXOBUTANOICACID
4oxo4(5(thiophen2yl)3(ptolyl)45dihydro1Hpyrazol1yl)butanoicacid
4OXO4(5THIOPHEN2YL3PTOLYL45DIHYDROPYRAZOL1YL)BUTYRICACID
799794517
CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CS3)C(=O)CCC(=O)O
InChI=1SC18H18N2O3Sc1124613(7512)141115(1632102416)20(1914)17(21)8918(22)23h271015H8911H21H3(H2223)
MFCD03677055
ZINC000000554145
ZINC000000554146
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