Vitas-M small molecule compound

(E)-{2-(4-tert-butylphenyl)-1-[2-(dimethylammonio)ethyl]-4,5-dioxopyrrolidin-3-ylidene}(2,4-dimethyl-1,3-thiazol-5-yl)methanolate

Catalog ID
STL150320
SMILES Cc1sc(c(n1)C)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)CC[NH+](C)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 C24H31N3O3S MW 441.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O3S/c1-14-22(31-15(2)25-14)20(28)18-19(16-8-10-17(11-9-16)24(3,4)5)27(13-12-26(6)7)23(30)21(18)29/h8-11,19,28H,12-13H2,1-7H3/b20-18+
InChIKey
PUQNLMLZTOVREG-CZIZESTLSA-N
Synonyms

(E)(2(4tertbutylphenyl)1(2(dimethylammonio)ethyl)45dioxopyrrolidin3ylidene)(24dimethyl13thiazol5yl)methanolate
Cc1sc(c(n1)C)C(=C1C(=O)C(=O)N(C1c1ccc(cc1)C(C)(C)C)CC(NH+)(C)C)(O)
MFCD20755802
ZINC000102930231
ZINC000102930232

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Available files

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