Vitas-M small molecule compound
4-[(3E)-3-({5-[4-(ethoxycarbonyl)phenyl]furan-2-yl}methylidene)-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl]benzoic acid
Catalog ID
STK193111
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\C=C(N(C1=O)c1ccc(cc1)C(=O)O)c1ccccc1
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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 C31H23NO6 MW 505.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H23NO6/c1-2-37-31(36)23-10-8-21(9-11-23)28-17-16-26(38-28)18-24-19-27(20-6-4-3-5-7-20)32(29(24)33)25-14-12-22(13-15-25)30(34)35/h3-19H,2H2,1H3,(H,34,35)/b24-18+InChIKey
OQCPJLSSYDYAPS-HKOYGPOVSA-NSynonyms
4((3E)3((5(4(ETHOXYCARBONYL)PHENYL)FURAN2YL)METHYLIDENE)2OXO5PHENYL23DIHYDRO1HPYRROL1YL)BENZOICACID
4((3E)3((5(4ETHOXYCARBONYLPHENYL)FURAN2YL)METHYLIDENE)2OXO5PHENYLPYRROL1YL)BENZOICACID
CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C=C(N(C3=O)C4=CC=C(C=C4)C(=O)O)C5=CC=CC=C5
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C1C=C(N(C1=O)c1ccc(cc1)C(=O)O)c1ccccc1
InChI=1SC31H23NO6c123731(36)2310821(91123)28171626(3828)18241927(206435720)32(29(24)33)25141222(131525)30(34)35h319H2H21H3(H3435)b2418+
MFCD01444279
ZINC000012363175
ZINC12363175
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