Vitas-M small molecule compound

methyl (4-{(Z)-[3-(2-cyclopentylethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-2-methoxyphenoxy)acetate

Catalog ID
STL368851
SMILES COC(=O)COc1ccc(cc1OC)/C=C/1\SC(=S)N(C1=O)CCC1CCCC1

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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 C21H25NO5S2 MW 435.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO5S2/c1-25-17-11-15(7-8-16(17)27-13-19(23)26-2)12-18-20(24)22(21(28)29-18)10-9-14-5-3-4-6-14/h7-8,11-12,14H,3-6,9-10,13H2,1-2H3/b18-12-
InChIKey
KNUWLFARLNJDOM-PDGQHHTCSA-N
Synonyms
COC(=O)COc1ccc(cc1OC)C=C1SC(=S)N(C1=O)CCC1CCCC1
COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)CCC3CCCC3)OCC(=O)OC
methyl(4((Z)(3(2cyclopentylethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)2methoxyphenoxy)acetate
METHYL2(4((Z)(3(2CYCLOPENTYLETHYL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)2METHOXYPHENOXY)ACETATE
Registry IDs
MFCD03715067
ZINC000001133820
ZINC01133820
ZINC1133820

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Available files

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