Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(2-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STL049526
SMILES CCOc1ccccc1C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[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 C28H36N2O5 MW 480.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N2O5/c1-6-29(7-2)17-18-30-25(22-11-9-10-12-23(22)34-8-3)24(27(32)28(30)33)26(31)20-13-15-21(16-14-20)35-19(4)5/h9-16,19,25,31H,6-8,17-18H2,1-5H3/b26-24+InChIKey
RGPIPJYVBKSFSQ-SHHOIMCASA-NSynonyms
846064-13-9(4E)1(2DIETHYLAMINOETHYL)5(2ETHOXYPHENYL)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(2ethoxyphenyl)45dioxopyrrolidin3ylidene)(4(propan2yloxy)phenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(2ETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4PROPAN2YLOXYPHENYL)METHANOLATE
846064139
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)OC(C)C)(O))C(=O)C1=O)C3=CC=CC=C3OCC
CCOc1ccccc1C1N(CC(NH+)(CC)CC)C(=O)C(=O)C1=C(c1ccc(cc1)OC(C)C)(O)
InChI=1SC28H36N2O5c1629(72)17183025(22119101223(22)3483)24(27(32)28(30)33)26(31)20131521(161420)3519(4)5h916192531H681718H215H3b2624+
MFCD18249275
ZINC000009359551
ZINC000009359554
Check stock
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Check stock on Vitas-MAvailable files
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