Vitas-M small molecule compound

(E)-(3-chloro-4-ethoxyphenyl){1-[2-(dimethylammonio)ethyl]-2-(4-ethoxyphenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate

Catalog ID
STL037333
SMILES CCOc1ccc(cc1)C1/C(=C(/c2ccc(c(c2)Cl)OCC)\[O-])/C(=O)C(=O)N1CC[NH+](C)C

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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 C25H29ClN2O5 MW 472.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClN2O5/c1-5-32-18-10-7-16(8-11-18)22-21(24(30)25(31)28(22)14-13-27(3)4)23(29)17-9-12-20(33-6-2)19(26)15-17/h7-12,15,22,29H,5-6,13-14H2,1-4H3/b23-21+
InChIKey
VLCZZVFIDAUXQA-XTQSDGFTSA-N
Synonyms
615278-71-2
(4E)4((3chloro4ethoxyphenyl)hydroxymethylidene)1(2(dimethylamino)ethyl)5(4ethoxyphenyl)pyrrolidine23dione
(4E)4((3CHLORO4ETHOXYPHENYL)HYDROXYMETHYLIDENE)1(2DIMETHYLAMINOETHYL)5(4ETHOXYPHENYL)PYRROLIDINE23DIONE
(E)(3chloro4ethoxyphenyl)(1(2(dimethylammonio)ethyl)2(4ethoxyphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4ETHOXYPHENYL)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4ETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)4((3CHLORO4ETHOXYPHENYL)CARBONYL)5(4ETHOXYPHENYL)3HYDROXY3PYRROLIN2ONE
4(3CHLORO4ETHOXYBENZOYL)1(2(DIMETHYLAMINO)ETHYL)5(4ETHOXYPHENYL)3HYDROXY15DIHYDRO2HPYRROL2ONE
615278712
CCOC1=CC=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OCC)Cl)O)C(=O)C(=O)N2CCN(C)C
CCOc1ccc(cc1)C1C(=C(c2ccc(c(c2)Cl)OCC)(O))C(=O)C(=O)N1CC(NH+)(C)C
InChI=1SC25H29ClN2O5c15321810716(81118)2221(24(30)25(31)28(22)141327(3)4)23(29)1791220(3362)19(26)1517h712152229H561314H214H3b2321+
MFCD18247403
ZINC000009339589
ZINC000009339590

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Available files

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