Vitas-M small molecule compound

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

Catalog ID
STK565377
SMILES COc1cccc(c1)C1/C(=C(/c2ccc(c(c2)Cl)OC)\[O-])/C(=O)C(=O)N1CCC[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 C24H27ClN2O5 MW 458.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClN2O5/c1-26(2)11-6-12-27-21(15-7-5-8-17(13-15)31-3)20(23(29)24(27)30)22(28)16-9-10-19(32-4)18(25)14-16/h5,7-10,13-14,21,28H,6,11-12H2,1-4H3/b22-20+
InChIKey
AMDWLRGHOYJRJX-LSDHQDQOSA-N
Synonyms
636987-42-3
(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIMETHYLAMINO)PROPYL)5(3METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(1(3(dimethylammonio)propyl)2(3methoxyphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(1(3(DIMETHYLAZANIUMYL)PROPYL)2(3METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIMETHYLAMINO)PROPYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(3METHOXYPHENYL)3PYRROLIN2ONE
636987423
C(NH+)(C)CCCN1C(C(=C(C2=CC(=C(C=C2)OC)Cl)(O))C(=O)C1=O)C3=CC(=CC=C3)OC
COc1cccc(c1)C1C(=C(c2ccc(c(c2)Cl)OC)(O))C(=O)C(=O)N1CCC(NH+)(C)C
InChI=1SC24H27ClN2O5c126(2)116122721(1575817(1315)313)20(23(29)24(27)30)22(28)1691019(324)18(25)1416h571013142128H61112H214H3b2220+
MFCD18244766
ZINC000009186484
ZINC000009241479

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Available files

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