Vitas-M small molecule compound

methyl (2-{(Z)-[2,4-dioxo-3-(prop-2-en-1-yl)-1,3-thiazolidin-5-ylidene]methyl}phenoxy)acetate

Catalog ID
STL368781
SMILES C=CCN1C(=O)S/C(=C\c2ccccc2OCC(=O)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 C16H15NO5S MW 333.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15NO5S/c1-3-8-17-15(19)13(23-16(17)20)9-11-6-4-5-7-12(11)22-10-14(18)21-2/h3-7,9H,1,8,10H2,2H3/b13-9-
InChIKey
CHJXJHAFJSVRDO-LCYFTJDESA-N
Synonyms

C=CCN1C(=O)SC(=Cc2ccccc2OCC(=O)OC)C1=O
COC(=O)COC1=CC=CC=C1C=C2C(=O)N(C(=O)S2)CC=C
InChI=1SC16H15NO5Sc1381715(19)13(2316(17)20)911645712(11)221014(18)212h379H1810H22H3b139
methyl(2((Z)(24dioxo3(prop2en1yl)13thiazolidin5ylidene)methyl)phenoxy)acetate
METHYL2(2((Z)(24DIOXO3PROP2ENYL13THIAZOLIDIN5YLIDENE)METHYL)PHENOXY)ACETATE
MFCD03273175
ZINC000015010926
ZINC15010926

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Available files

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