Vitas-M small molecule compound
4-[5-(5-methylfuran-2-yl)-3-(thiophen-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STL009614
SMILES OC(=O)CCC(=O)N1N=C(CC1c1ccc(o1)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 C16H16N2O4S MW 332.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O4S/c1-10-4-5-13(22-10)12-9-11(14-3-2-8-23-14)17-18(12)15(19)6-7-16(20)21/h2-5,8,12H,6-7,9H2,1H3,(H,20,21)InChIKey
VPJOPLCINMSKRI-UHFFFAOYSA-NSynonyms
877972-11-74(3(5methylfuran2yl)5thiophen2yl34dihydropyrazol2yl)4oxobutanoicacid
4(5(5methylfuran2yl)3(thiophen2yl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
877972117
CC1=CC=C(O1)C2CC(=NN2C(=O)CCC(=O)O)C3=CC=CS3
InChI=1SC16H16N2O4Sc1104513(2210)12911(143282314)1718(12)15(19)6716(20)21h25812H679H21H3(H2021)
MFCD07851034
ZINC000007986617
ZINC000007986618
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