Vitas-M small molecule compound

ethyl 4-[(5Z)-5-(4-methylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoate

Catalog ID
STK837339
SMILES CCOC(=O)CCCN1C(=S)S/C(=C\c2ccc(cc2)C)/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 C17H19NO3S2 MW 349.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO3S2/c1-3-21-15(19)5-4-10-18-16(20)14(23-17(18)22)11-13-8-6-12(2)7-9-13/h6-9,11H,3-5,10H2,1-2H3/b14-11-
InChIKey
PDEPVJVKHVLLNC-KAMYIIQDSA-N
Synonyms

(Z)ethyl4(5(4methylbenzylidene)4oxo2thioxothiazolidin3yl)butanoate
CCOC(=O)CCCN1C(=O)C(=CC2=CC=C(C=C2)C)SC1=S
CCOC(=O)CCCN1C(=S)SC(=Cc2ccc(cc2)C)C1=O
ETHYL4((5Z)5((4METHYLPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)BUTANOATE
ethyl4((5Z)5(4methylbenzylidene)4oxo2thioxo13thiazolidin3yl)butanoate
InChI=1SC17H19NO3S2c132115(19)54101816(20)14(2317(18)22)11138612(2)7913h6911H3510H212H3b1411
MFCD02369851
ZINC000004725621
ZINC04725621
ZINC4725621

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Available files

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