Vitas-M small molecule compound

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

Catalog ID
STL150396
SMILES COc1ccc(cc1)C1N(CCC[NH+](CC)CC)C(=O)C(=O)/C/1=C(\c1ccc(c(c1)Cl)OC)/[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 C26H31ClN2O5 MW 487.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31ClN2O5/c1-5-28(6-2)14-7-15-29-23(17-8-11-19(33-3)12-9-17)22(25(31)26(29)32)24(30)18-10-13-21(34-4)20(27)16-18/h8-13,16,23,30H,5-7,14-15H2,1-4H3/b24-22+
InChIKey
QURUPNXMJNOKLX-ZNTNEXAZSA-N
Synonyms
636987-46-7
(4E)4((3CHLORO4METHOXYPHENYL)HYDROXYMETHYLIDENE)1(3(DIETHYLAMINO)PROPYL)5(4METHOXYPHENYL)PYRROLIDINE23DIONE
(E)(3chloro4methoxyphenyl)(1(3(diethylammonio)propyl)2(4methoxyphenyl)45dioxopyrrolidin3ylidene)methanolate
(E)(3CHLORO4METHOXYPHENYL)(1(3(DIETHYLAZANIUMYL)PROPYL)2(4METHOXYPHENYL)45DIOXOPYRROLIDIN3YLIDENE)METHANOLATE
1(3(DIETHYLAMINO)PROPYL)4((3CHLORO4METHOXYPHENYL)CARBONYL)3HYDROXY5(4METHOXYPHENYL)3PYRROLIN2ONE
636987467
CCN(CC)CCCN1C(C(=C(C2=CC(=C(C=C2)OC)Cl)O)C(=O)C1=O)C3=CC=C(C=C3)OC
COc1ccc(cc1)C1N(CCC(NH+)(CC)CC)C(=O)C(=O)C1=C(c1ccc(c(c1)Cl)OC)(O)
InChI=1SC26H31ClN2O5c1528(62)147152923(1781119(333)12917)22(25(31)26(29)32)24(30)18101321(344)20(27)1618h813162330H571415H214H3b2422+
MFCD20755817
ZINC000009122130
ZINC000009122132

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Available files

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