Vitas-M small molecule compound
6-[(3E)-3-[(4-bromophenyl)(hydroxy)methylidene]-2-(4-chlorophenyl)-4,5-dioxopyrrolidin-1-yl]hexanoic acid
Catalog ID
STL046439
SMILES OC(=O)CCCCCN1C(c2ccc(cc2)Cl)/C(=C(/c2ccc(cc2)Br)\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 C23H21BrClNO5 MW 506.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrClNO5/c24-16-9-5-15(6-10-16)21(29)19-20(14-7-11-17(25)12-8-14)26(23(31)22(19)30)13-3-1-2-4-18(27)28/h5-12,20,29H,1-4,13H2,(H,27,28)/b21-19+InChIKey
XQVROPNJVUWEAI-XUTLUUPISA-NSynonyms
488087-44-1488087441
6((3E)3((4bromophenyl)(hydroxy)methylidene)2(4chlorophenyl)45dioxopyrrolidin1yl)hexanoicacid
6((3E)3((4BROMOPHENYL)HYDROXYMETHYLIDENE)2(4CHLOROPHENYL)45DIOXOPYRROLIDIN1YL)HEXANOICACID
C1=CC(=CC=C1C2C(=C(C3=CC=C(C=C3)Br)O)C(=O)C(=O)N2CCCCCC(=O)O)Cl
InChI=1SC23H21BrClNO5c24169515(61016)21(29)1920(1471117(25)12814)26(23(31)22(19)30)13312418(27)28h5122029H1413H2(H2728)b2119+
MFCD03815401
OC(=O)CCCCCN1C(c2ccc(cc2)Cl)C(=C(c2ccc(cc2)Br)O)C(=O)C1=O
ZINC000009270364
ZINC000009270366
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