Vitas-M small molecule compound
methyl 4-[(3Z)-3-(3-bromo-4-methoxybenzylidene)-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl]benzoate
Catalog ID
STK199226
SMILES COC(=O)c1ccc(cc1)N1C(=O)/C(=C\c2ccc(c(c2)Br)OC)/C=C1c1ccccc1
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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 C26H20BrNO4 MW 490.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20BrNO4/c1-31-24-13-8-17(15-22(24)27)14-20-16-23(18-6-4-3-5-7-18)28(25(20)29)21-11-9-19(10-12-21)26(30)32-2/h3-16H,1-2H3/b20-14-InChIKey
FDWQIBZBOVHOLL-ZHZULCJRSA-NSynonyms
COC(=O)c1ccc(cc1)N1C(=O)C(=Cc2ccc(c(c2)Br)OC)C=C1c1ccccc1
COC1=C(C=C(C=C1)C=C2C=C(N(C2=O)C3=CC=C(C=C3)C(=O)OC)C4=CC=CC=C4)Br
InChI=1SC26H20BrNO4c1312413817(1522(24)27)14201623(186435718)28(25(20)29)2111919(101221)26(30)322h316H12H3b2014
methyl4((3Z)3((3bromo4methoxyphenyl)methylidene)2oxo5phenylpyrrol1yl)benzoate
METHYL4((3Z)3(3BROMO4METHOXYBENZYLIDENE)2OXO5PHENYL23DIHYDRO1HPYRROL1YL)BENZOATE
MFCD04529668
ZINC000009262095
ZINC09262095
ZINC9262095
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