Vitas-M small molecule compound

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

Catalog ID
STL046389
SMILES COc1c(OC)cccc1C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1sc(nc1C)C)/[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 C25H31N3O6S MW 501.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O6S/c1-15-24(35-16(2)26-15)21(29)19-20(17-7-5-8-18(32-3)23(17)33-4)28(25(31)22(19)30)10-6-9-27-11-13-34-14-12-27/h5,7-8,20,29H,6,9-14H2,1-4H3/b21-19+
InChIKey
JNNSNMFNWPOWAY-XUTLUUPISA-N
Synonyms

(E)(2(23dimethoxyphenyl)1(3(morpholin4ium4yl)propyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
COc1c(OC)cccc1C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1sc(nc1C)C)(O)
MFCD18248839
ZINC000102880395
ZINC000102880400

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Available files

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