Vitas-M small molecule compound
4-[3-(4-bromophenyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STK534214
SMILES OC(=O)CCC(=O)N1N=C(CC1c1ccco1)c1ccc(cc1)Br
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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 C17H15BrN2O4 MW 391.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN2O4/c18-12-5-3-11(4-6-12)13-10-14(15-2-1-9-24-15)20(19-13)16(21)7-8-17(22)23/h1-6,9,14H,7-8,10H2,(H,22,23)InChIKey
BKYZHVABKWQOFK-UHFFFAOYSA-NSynonyms
4((5R)3(4BROMOPHENYL)5(FURAN2YL)45DIHYDRO1HPYRAZOL1YL)4OXOBUTANOICACID
4(3(4bromophenyl)5(furan2yl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4(5(4BROMOPHENYL)3(FURAN2YL)34DIHYDROPYRAZOL2YL)4OXOBUTANOICACID
C1C(N(N=C1C2=CC=C(C=C2)Br)C(=O)CCC(=O)O)C3=CC=CO3
InChI=1SC17H15BrN2O4c18125311(4612)131014(152192415)20(1913)16(21)7817(22)23h16914H7810H2(H2223)
MFCD02048511
ZINC000004863196
ZINC000004863197
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