Vitas-M small molecule compound
4-[5'-(1-benzofuran-2-yl)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrazol]-2'(4'H)-yl]-4-oxobutanoic acid
Catalog ID
STK602528
SMILES OC(=O)CCC(=O)N1N=C(CC21C(=O)Nc1c2cccc1)c1cc2c(o1)cccc2
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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 C22H17N3O5 MW 403.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O5/c26-19(9-10-20(27)28)25-22(14-6-2-3-7-15(14)23-21(22)29)12-16(24-25)18-11-13-5-1-4-8-17(13)30-18/h1-8,11H,9-10,12H2,(H,23,29)(H,27,28)InChIKey
MCAFNBINNVGXIX-UHFFFAOYSA-NSynonyms
921077-81-84(3(1benzofuran2yl)2oxospiro(1Hindole354Hpyrazole)1yl)4oxobutanoicacid
4(5(1benzofuran2yl)2oxo12dihydrospiro(indole33pyrazol)2(4H)yl)4oxobutanoicacid
4(5(benzofuran2yl)2oxospiro(indoline33pyrazol)2(4H)yl)4oxobutanoicacid
921077818
C1C(=NN(C12C3=CC=CC=C3NC2=O)C(=O)CCC(=O)O)C4=CC5=CC=CC=C5O4
InChI=1SC22H17N3O5c2619(91020(27)28)2522(14623715(14)2321(22)29)1216(2425)181113514817(13)3018h1811H91012H2(H2329)(H2728)
MFCD08746180
ZINC000009303183
ZINC000013626344
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