Vitas-M small molecule compound

(4E)-4-[hydroxy(4-methoxyphenyl)methylidene]-1-(pyrimidin-2-yl)-5-(thiophen-2-yl)pyrrolidine-2,3-dione

Catalog ID
STK543491
SMILES COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccs1)c1ncccn1)/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 C20H15N3O4S MW 393.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N3O4S/c1-27-13-7-5-12(6-8-13)17(24)15-16(14-4-2-11-28-14)23(19(26)18(15)25)20-21-9-3-10-22-20/h2-11,16,24H,1H3/b17-15+
InChIKey
XBOMBPCRAWQMCJ-BMRADRMJSA-N
Synonyms
385417-93-6
(4E)4(hydroxy(4methoxyphenyl)methylidene)1(pyrimidin2yl)5(thiophen2yl)pyrrolidine23dione
(4E)4(HYDROXY(4METHOXYPHENYL)METHYLIDENE)1PYRIMIDIN2YL5THIOPHEN2YLPYRROLIDINE23DIONE
385417936
3HYDROXY4((4METHOXYPHENYL)CARBONYL)1PYRIMIDIN2YL5(2THIENYL)3PYRROLIN2ONE
COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)C3=NC=CC=N3)C4=CC=CS4)O
COc1ccc(cc1)C(=C1C(=O)C(=O)N(C1c1cccs1)c1ncccn1)O
InChI=1SC20H15N3O4Sc127137512(6813)17(24)1516(1442112814)23(19(26)18(15)25)202193102220h2111624H1H3b1715+
MFCD08735468
ZINC000102435912
ZINC000102435916

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Available files

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