Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}(4-methoxyphenyl)methanolate
Catalog ID
STK559833
SMILES CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)OC)\[O-])/C(=O)C(=O)N1CC[NH+](CC)CC
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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 C27H34N2O5 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O5/c1-5-18-34-22-14-8-19(9-15-22)24-23(25(30)20-10-12-21(33-4)13-11-20)26(31)27(32)29(24)17-16-28(6-2)7-3/h8-15,24,30H,5-7,16-18H2,1-4H3/b25-23+InChIKey
KSUGQLZYPNRVKR-WJTDDFOZSA-NSynonyms
615270-92-3(4E)1(2DIETHYLAMINOETHYL)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)5(4PROPOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)45dioxo2(4propoxyphenyl)pyrrolidin3ylidene)(4methoxyphenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)45DIOXO2(4PROPOXYPHENYL)PYRROLIDIN3YLIDENE)(4METHOXYPHENYL)METHANOLATE
1(2(DIETHYLAMINO)ETHYL)3HYDROXY4((4METHOXYPHENYL)CARBONYL)5(4PROPOXYPHENYL)3PYRROLIN2ONE
615270923
CCCOC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OC)(O))C(=O)C(=O)N2CC(NH+)(CC)CC
CCCOc1ccc(cc1)C1C(=C(c2ccc(cc2)OC)(O))C(=O)C(=O)N1CC(NH+)(CC)CC
InChI=1SC27H34N2O5c1518342214819(91522)2423(25(30)20101221(334)131120)26(31)27(32)29(24)171628(62)73h8152430H571618H214H3b2523+
MFCD18243382
ZINC000102490838
ZINC000102490848
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.