Vitas-M small molecule compound

(2E)-4-{[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl](2-phenylethyl)amino}-4-oxobut-2-enoic acid

Catalog ID
STK391941
SMILES COc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)/C=C/C(=O)O)CCc1ccccc1

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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 C23H22N2O6 MW 422.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N2O6/c1-31-18-9-7-17(8-10-18)25-21(27)15-19(23(25)30)24(20(26)11-12-22(28)29)14-13-16-5-3-2-4-6-16/h2-12,19H,13-15H2,1H3,(H,28,29)/b12-11+
InChIKey
LTKZBUONMLKFLN-VAWYXSNFSA-N
Synonyms
355403-50-8
(2E)4((1(4methoxyphenyl)25dioxopyrrolidin3yl)(2phenylethyl)amino)4oxobut2enoicacid
(E)4((1(4methoxyphenyl)25dioxopyrrolidin3yl)(2phenylethyl)amino)4oxobut2enoicacid
(E)4((1(4methoxyphenyl)25dioxopyrrolidin3yl)(phenethyl)amino)4oxobut2enoicacid
(E)4((1(4METHOXYPHENYL)25DIOXOPYRROLIDIN3YL)PHENETHYLAMINO)4OXOBUT2ENOICACID
355403508
4((1(4METHOXYPHENYL)25DIOXO3PYRROLIDINYL)(2PHENYLETHYL)AMINO)4OXO2BUTENOICACID
COC1=CC=C(C=C1)N2C(=O)CC(C2=O)N(CCC3=CC=CC=C3)C(=O)C=CC(=O)O
COc1ccc(cc1)N1C(=O)CC(C1=O)N(C(=O)C=CC(=O)O)CCc1ccccc1
InChI=1SC23H22N2O6c131189717(81018)2521(27)1519(23(25)30)24(20(26)111222(28)29)1413165324616h21219H1315H21H3(H2829)b1211+
MFCD00759156
ZINC000001995038
ZINC000019720981

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.