Vitas-M small molecule compound

(5E)-3-ethyl-5-[4-(methylsulfanyl)benzylidene]-1,3-thiazolidine-2,4-dione

Catalog ID
STK155003
SMILES CCN1C(=O)S/C(=C/c2ccc(cc2)SC)/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 C13H13NO2S2 MW 279.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO2S2/c1-3-14-12(15)11(18-13(14)16)8-9-4-6-10(17-2)7-5-9/h4-8H,3H2,1-2H3/b11-8+
InChIKey
KARKDRIQZCWRTG-DHZHZOJOSA-N
Synonyms

(5E)3ETHYL5((4METHYLSULFANYLPHENYL)METHYLIDENE)13THIAZOLIDINE24DIONE
(5E)3ETHYL5(4(METHYLSULFANYL)BENZYLIDENE)13THIAZOLIDINE24DIONE
CCN1C(=O)C(=CC2=CC=C(C=C2)SC)SC1=O
CCN1C(=O)SC(=Cc2ccc(cc2)SC)C1=O
InChI=1SC13H13NO2S2c131412(15)11(1813(14)16)894610(172)759h48H3H212H3b118+
MFCD03722055
ZINC000004695156
ZINC04695156
ZINC4695156

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Available files

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