Vitas-M small molecule compound
(E)-{1-[2-(diethylammonio)ethyl]-2-(2-methoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}[4-(2-methylpropoxy)phenyl]methanolate
Catalog ID
STL052135
SMILES COc1ccccc1C1N(CC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OCC(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)16-17-30-25(22-10-8-9-11-23(22)34-5)24(27(32)28(30)33)26(31)20-12-14-21(15-13-20)35-18-19(3)4/h8-15,19,25,31H,6-7,16-18H2,1-5H3/b26-24+InChIKey
HUTKTWOUNRUKDA-SHHOIMCASA-NSynonyms
848728-79-0(4E)1(2DIETHYLAMINOETHYL)4(HYDROXY(4(2METHYLPROPOXY)PHENYL)METHYLIDENE)5(2METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(2(diethylammonio)ethyl)2(2methoxyphenyl)45dioxopyrrolidin3ylidene)(4(2methylpropoxy)phenyl)methanolate
(E)(1(2(DIETHYLAZANIUMYL)ETHYL)2(2METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(4(2METHYLPROPOXY)PHENYL)METHANOLATE
848728790
CC(NH+)(CC)CCN1C(C(=C(C2=CC=C(C=C2)OCC(C)C)(O))C(=O)C1=O)C3=CC=CC=C3OC
COc1ccccc1C1N(CC(NH+)(CC)CC)C(=O)C(=O)C1=C(c1ccc(cc1)OCC(C)C)(O)
InChI=1SC28H36N2O5c1629(72)16173025(2210891123(22)345)24(27(32)28(30)33)26(31)20121421(151320)351819(3)4h815192531H671618H215H3b2624+
MFCD18249442
ZINC000009244065
ZINC000009244066
Check stock
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Check stock on Vitas-MAvailable files
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