Vitas-M small molecule compound

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

Catalog ID
STL035917
SMILES CCCOC(=O)CN1C(=S)S/C(=C/c2ccc(c(c2)OC)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 C17H19NO5S2 MW 381.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19NO5S2/c1-4-7-23-15(19)10-18-16(20)14(25-17(18)24)9-11-5-6-12(21-2)13(8-11)22-3/h5-6,8-9H,4,7,10H2,1-3H3/b14-9+
InChIKey
GPKPNOSYOVWBNJ-NTEUORMPSA-N
Synonyms

CCCOC(=O)CN1C(=O)C(=CC2=CC(=C(C=C2)OC)OC)SC1=S
CCCOC(=O)CN1C(=S)SC(=Cc2ccc(c(c2)OC)OC)C1=O
InChI=1SC17H19NO5S2c1472315(19)101816(20)14(2517(18)24)9115612(212)13(811)223h5689H4710H213H3b149+
MFCD18192240
propyl((5E)5(34dimethoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetate
PROPYL2((5E)5((34DIMETHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETATE
ZINC000006073041
ZINC06073041
ZINC6073041

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Available files

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