Vitas-M small molecule compound

(E)-{2-(4-methoxyphenyl)-1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxopyrrolidin-3-ylidene}(thiophen-2-yl)methanolate

Catalog ID
STL039072
SMILES COc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1cccs1)/[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 C23H26N2O5S MW 442.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N2O5S/c1-29-17-7-5-16(6-8-17)20-19(21(26)18-4-2-15-31-18)22(27)23(28)25(20)10-3-9-24-11-13-30-14-12-24/h2,4-8,15,20,26H,3,9-14H2,1H3/b21-19+
InChIKey
FWGVVEPHQDENLZ-XUTLUUPISA-N
Synonyms

(E)(2(4methoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(thiophen2yl)methanolate
COc1ccc(cc1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1cccs1)(O)
MFCD18247764
ZINC000009274436
ZINC000009274441

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Available files

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