Vitas-M small molecule compound

propyl 4-[(5E)-5-(4-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoate

Catalog ID
STK805389
SMILES CCCOC(=O)CCCN1C(=S)S/C(=C/c2ccc(cc2)OC)/C1=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 C18H21NO4S2 MW 379.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21NO4S2/c1-3-11-23-16(20)5-4-10-19-17(21)15(25-18(19)24)12-13-6-8-14(22-2)9-7-13/h6-9,12H,3-5,10-11H2,1-2H3/b15-12+
InChIKey
MGIXZFXLRYXHLK-NTCAYCPXSA-N
Synonyms

(Z)propyl4(5(4methoxybenzylidene)4oxo2thioxothiazolidin3yl)butanoate
CCCOC(=O)CCCN1C(=O)C(=CC2=CC=C(C=C2)OC)SC1=S
CCCOC(=O)CCCN1C(=S)SC(=Cc2ccc(cc2)OC)C1=O
InChI=1SC18H21NO4S2c13112316(20)54101917(21)15(2518(19)24)12136814(222)9713h6912H351011H212H3b1512+
MFCD18169555
PROPYL4((5E)5((4METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOATE
propyl4((5E)5(4methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)butanoate
ZINC000005892295
ZINC05892295
ZINC5892295

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Available files

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