Vitas-M small molecule compound

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

Catalog ID
STK563155
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)OC)/[O-])/C1c1cc(OC)ccc1OC)CC

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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 C27H34N2O6 MW 482.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O6/c1-6-28(7-2)14-9-15-29-24(21-17-20(34-4)12-13-22(21)35-5)23(26(31)27(29)32)25(30)18-10-8-11-19(16-18)33-3/h8,10-13,16-17,24,30H,6-7,9,14-15H2,1-5H3/b25-23+
InChIKey
NFYXDBHFYRODFD-WJTDDFOZSA-N
Synonyms
615276-97-6
(4E)1(3(DIETHYLAMINO)PROPYL)5(25DIMETHOXYPHENYL)4(HYDROXY(3METHOXYPHENYL)METHYLIDENE)PYRROLIDINE23DIONE
(E)(1(3(diethylammonio)propyl)2(25dimethoxyphenyl)45dioxopyrrolidin3ylidene)(3methoxyphenyl)methanolate
(E)(1(3(DIETHYLAZANIUMYL)PROPYL)2(25DIMETHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)(3METHOXYPHENYL)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)5(25DIMETHOXYPHENYL)3HYDROXY4((3METHOXYPHENYL)CARBONYL)3PYRROLIN2ONE
615276976
CC(NH+)(CC)CCCN1C(C(=C(C2=CC(=CC=C2)OC)(O))C(=O)C1=O)C3=C(C=CC(=C3)OC)OC
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2cccc(c2)OC)(O))C1c1cc(OC)ccc1OC)CC
InChI=1SC27H34N2O6c1628(72)149152924(211720(344)121322(21)355)23(26(31)27(29)32)25(30)181081119(1618)333h8101316172430H6791415H215H3b2523+
MFCD18244225
ZINC000008818150
ZINC000102518205

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Available files

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