Vitas-M small molecule compound

(E)-[1-(6-methylpyridinium-2-yl)-4,5-dioxo-2-phenylpyrrolidin-3-ylidene](thiophen-2-yl)methanolate

Catalog ID
STK559397
SMILES Cc1cccc([nH+]1)N1C(=O)C(=O)/C(=C(\c2cccs2)/[O-])/C1c1ccccc1

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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 C21H16N2O3S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O3S/c1-13-7-5-11-16(22-13)23-18(14-8-3-2-4-9-14)17(20(25)21(23)26)19(24)15-10-6-12-27-15/h2-12,18,24H,1H3/b19-17+
InChIKey
AHLODUKJSKXMHH-HTXNQAPBSA-N
Synonyms

Cc1cccc((nH+)1)N1C(=O)C(=O)C(=C(c2cccs2)(O))C1c1ccccc1
MFCD18243254
ZINC000102486724
ZINC000102486733

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Available files

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