Vitas-M small molecule compound

ethyl (2-chloro-4-{(E)-[2,4-dioxo-3-(prop-2-yn-1-yl)-1,3-thiazolidin-5-ylidene]methyl}-6-methoxyphenoxy)acetate

Catalog ID
STK152501
SMILES C#CCN1C(=O)S/C(=C/c2cc(Cl)c(c(c2)OC)OCC(=O)OCC)/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 C18H16ClNO6S MW 409.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16ClNO6S/c1-4-6-20-17(22)14(27-18(20)23)9-11-7-12(19)16(13(8-11)24-3)26-10-15(21)25-5-2/h1,7-9H,5-6,10H2,2-3H3/b14-9+
InChIKey
AJHQSSZGCWVWNH-NTEUORMPSA-N
Synonyms

C#CCN1C(=O)SC(=Cc2cc(Cl)c(c(c2)OC)OCC(=O)OCC)C1=O
CCOC(=O)COC1=C(C=C(C=C1Cl)C=C2C(=O)N(C(=O)S2)CC#C)OC
ETHYL(2CHLORO4((24DIOXO3(2PROPYNYL)13THIAZOLIDIN5YLIDENE)METHYL)6METHOXYPHENOXY)ACETATE
ETHYL(2CHLORO4((E)(24DIOXO3(PROP2YN1YL)13THIAZOLIDIN5YLIDENE)METHYL)6METHOXYPHENOXY)ACETATE
ETHYL2(2CHLORO4((E)(24DIOXO3PROP2YNYL13THIAZOLIDIN5YLIDENE)METHYL)6METHOXYPHENOXY)ACETATE
InChI=1SC18H16ClNO6Sc1462017(22)14(2718(20)23)911712(19)16(13(811)243)261015(21)2552h179H5610H223H3b149+
MFCD03068488
ZINC000000979914
ZINC00979914
ZINC979914

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Available files

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