Vitas-M small molecule compound
4-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid
Catalog ID
STL044188
SMILES OC(=O)CCCN1C(c2ccc(cc2)C)/C(=C(/c2ccc(cc2)Cl)\O)/C(=O)C1=O
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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 C22H20ClNO5 MW 413.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO5/c1-13-4-6-14(7-5-13)19-18(20(27)15-8-10-16(23)11-9-15)21(28)22(29)24(19)12-2-3-17(25)26/h4-11,19,27H,2-3,12H2,1H3,(H,25,26)/b20-18+InChIKey
SVRDYKHVGCBJHD-CZIZESTLSA-NSynonyms
488843-81-84((3E)3((4chlorophenyl)(hydroxy)methylidene)2(4methylphenyl)45dioxopyrrolidin1yl)butanoicacid
4((3E)3((4CHLOROPHENYL)HYDROXYMETHYLIDENE)2(4METHYLPHENYL)45DIOXOPYRROLIDIN1YL)BUTANOICACID
488843818
CC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C(=O)N2CCCC(=O)O
InChI=1SC22H20ClNO5c1134614(7513)1918(20(27)1581016(23)11915)21(28)22(29)24(19)122317(25)26h4111927H2312H21H3(H2526)b2018+
MFCD03807690
OC(=O)CCCN1C(c2ccc(cc2)C)C(=C(c2ccc(cc2)Cl)O)C(=O)C1=O
ZINC000006813176
ZINC000006813213
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