Vitas-M small molecule compound

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

Catalog ID
STL045594
SMILES COc1ccc(cc1OC)C1/C(=C(/c2ccc(cc2)C)\[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 C24H28N2O5 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O5/c1-15-6-8-16(9-7-15)22(27)20-21(17-10-11-18(30-4)19(14-17)31-5)26(13-12-25(2)3)24(29)23(20)28/h6-11,14,21,27H,12-13H2,1-5H3/b22-20+
InChIKey
PZXHHCXQUKJKGG-LSDHQDQOSA-N
Synonyms
381181-95-9
(4E)5(34dimethoxyphenyl)1(2(dimethylamino)ethyl)4(hydroxy(4methylphenyl)methylidene)pyrrolidine23dione
(4E)5(34DIMETHOXYPHENYL)1(2DIMETHYLAMINOETHYL)4(HYDROXY(4METHYLPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(2(34dimethoxyphenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)(4methylphenyl)methanolate
(E)(2(34DIMETHOXYPHENYL)1(2(DIMETHYLAZANIUMYL)ETHYL)45DIOXOPYRROLIDIN3YLIDENE)(4METHYLPHENYL)METHANOLATE
381181959
5(34DIMETHOXYPHENYL)1(2(DIMETHYLAMINO)ETHYL)3HYDROXY4(4METHYLBENZOYL)15DIHYDRO2HPYRROL2ONE
CC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC(=C(C=C3)OC)OC)O
COc1ccc(cc1OC)C1C(=C(c2ccc(cc2)C)(O))C(=O)C(=O)N1CC(NH+)(C)C
InChI=1SC24H28N2O5c1156816(9715)22(27)2021(17101118(304)19(1417)315)26(131225(2)3)24(29)23(20)28h611142127H1213H215H3b2220+
MFCD18248667
ZINC000102877832
ZINC000102877835

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Available files

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