Vitas-M small molecule compound
(3Z)-1-(1,3-benzodioxol-5-yl)-5-(4-chlorophenyl)-3-(4-methoxybenzylidene)-1,3-dihydro-2H-pyrrol-2-one
Catalog ID
STK199173
SMILES COc1ccc(cc1)/C=C\1/C=C(N(C1=O)c1ccc2c(c1)OCO2)c1ccc(cc1)Cl
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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 C25H18ClNO4 MW 431.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18ClNO4/c1-29-21-9-2-16(3-10-21)12-18-13-22(17-4-6-19(26)7-5-17)27(25(18)28)20-8-11-23-24(14-20)31-15-30-23/h2-14H,15H2,1H3/b18-12-InChIKey
JCWQZBYOEMZFPK-PDGQHHTCSA-NSynonyms
(3Z)1(13BENZODIOXOL5YL)5(4CHLOROPHENYL)3((4METHOXYPHENYL)METHYLIDENE)PYRROL2ONE
(3Z)1(13BENZODIOXOL5YL)5(4CHLOROPHENYL)3(4METHOXYBENZYLIDENE)13DIHYDRO2HPYRROL2ONE
COC1=CC=C(C=C1)C=C2C=C(N(C2=O)C3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Cl
COc1ccc(cc1)C=C1C=C(N(C1=O)c1ccc2c(c1)OCO2)c1ccc(cc1)Cl
InChI=1SC25H18ClNO4c129219216(31021)12181322(174619(26)7517)27(25(18)28)208112324(1420)31153023h214H15H21H3b1812
MFCD06150699
ZINC000001106424
ZINC01106424
ZINC1106424
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