Vitas-M small molecule compound

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

Catalog ID
STK565420
SMILES CC[NH+](CCCN1C(=O)C(=O)/C(=C(\c2sc(nc2C)C)/[O-])/C1c1ccc(c(c1)OC)OC)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 C25H33N3O5S MW 487.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N3O5S/c1-7-27(8-2)12-9-13-28-21(17-10-11-18(32-5)19(14-17)33-6)20(23(30)25(28)31)22(29)24-15(3)26-16(4)34-24/h10-11,14,21,29H,7-9,12-13H2,1-6H3/b22-20+
InChIKey
BRDVLBKACQVDDG-LSDHQDQOSA-N
Synonyms

(E)(1(3(diethylammonio)propyl)2(34dimethoxyphenyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
CC(NH+)(CCCN1C(=O)C(=O)C(=C(c2sc(nc2C)C)(O))C1c1ccc(c(c1)OC)OC)CC
MFCD18244782
ZINC000102534797
ZINC000102534804

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Available files

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