Vitas-M small molecule compound
3-{(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-1-yl}propanoic acid
Catalog ID
STK565482
SMILES OC(=O)CCN1C(=O)C(=O)/C(=C(\c2ccc(cc2)Cl)/O)/C1c1ccc(cc1)C(C)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 C23H22ClNO5 MW 427.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClNO5/c1-13(2)14-3-5-15(6-4-14)20-19(21(28)16-7-9-17(24)10-8-16)22(29)23(30)25(20)12-11-18(26)27/h3-10,13,20,28H,11-12H2,1-2H3,(H,26,27)/b21-19+InChIKey
WCYQDJQPMXKBFL-XUTLUUPISA-NSynonyms
439137-23-23((3E)3((4chlorophenyl)(hydroxy)methylidene)45dioxo2(4(propan2yl)phenyl)pyrrolidin1yl)propanoicacid
3((4E)4((4CHLOROPHENYL)HYDROXYMETHYLIDENE)23DIOXO5(4PROPAN2YLPHENYL)PYRROLIDIN1YL)PROPANOICACID
439137232
CC(C)C1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)Cl)O)C(=O)C(=O)N2CCC(=O)O
InChI=1SC23H22ClNO5c113(2)143515(6414)2019(21(28)167917(24)10816)22(29)23(30)25(20)121118(26)27h310132028H1112H212H3(H2627)b2119+
MFCD03801585
OC(=O)CCN1C(=O)C(=O)C(=C(c2ccc(cc2)Cl)O)C1c1ccc(cc1)C(C)C
ZINC000102649081
ZINC000102649083
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