Vitas-M small molecule compound

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

Catalog ID
STL044818
SMILES COc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C)CC[NH+](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 C23H25ClN2O4 MW 428.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25ClN2O4/c1-14-5-7-15(8-6-14)20-19(22(28)23(29)26(20)12-11-25(2)3)21(27)16-9-10-18(30-4)17(24)13-16/h5-10,13,20,27H,11-12H2,1-4H3/b21-19+
InChIKey
GZJWXPATSGRIBU-XUTLUUPISA-N
Synonyms
638133-85-4
(4E)4((3chloro4methoxyphenyl)hydroxymethylidene)1(2(dimethylamino)ethyl)5(4methylphenyl)pyrrolidine23dione
(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(2DIMETHYLAMINOETHYL)5(4METHYLPHENYL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(1(2(dimethylammonio)ethyl)2(4methylphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(1(2(DIMETHYLAZANIUMYL)ETHYL)2(4METHYLPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(2(DIMETHYLAMINO)ETHYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(4METHYLPHENYL)3PYRROLIN2ONE
638133854
CC1=CC=C(C=C1)C2C(=C(C3=CC(=C(C=C3)OC)Cl)O)C(=O)C(=O)N2CCN(C)C
COc1ccc(cc1Cl)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C)CC(NH+)(C)C)(O)
InChI=1SC23H25ClN2O4c1145715(8614)2019(22(28)23(29)26(20)121125(2)3)21(27)1691018(304)17(24)1316h510132027H1112H214H3b2119+
MFCD18248495
ZINC000102880659
ZINC000102880661

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Available files

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