Vitas-M small molecule compound

methyl 2-{(5E)-5-[4-(methylsulfanyl)benzylidene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate

Catalog ID
STK155267
SMILES COC(=O)C(N1C(=O)S/C(=C/c2ccc(cc2)SC)/C1=O)C

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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 C15H15NO4S2 MW 337.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15NO4S2/c1-9(14(18)20-2)16-13(17)12(22-15(16)19)8-10-4-6-11(21-3)7-5-10/h4-9H,1-3H3/b12-8+
InChIKey
QZEOTTCXNSJDGG-XYOKQWHBSA-N
Synonyms

CC(C(=O)OC)N1C(=O)C(=CC2=CC=C(C=C2)SC)SC1=O
COC(=O)C(N1C(=O)SC(=Cc2ccc(cc2)SC)C1=O)C
InChI=1SC15H15NO4S2c19(14(18)202)1613(17)12(2215(16)19)8104611(213)7510h49H13H3b128+
METHYL2((5E)5((4METHYLSULFANYLPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
METHYL2((5E)5(4(METHYLSULFANYL)BENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
MFCD03923103
ZINC000004695272
ZINC000004695274

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Available files

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