Vitas-M small molecule compound

ethyl (2Z)-cyano[5-(4-fluorobenzyl)-3-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]ethanoate

Catalog ID
STL022143
SMILES CCOC(=O)/C(=C/1\SC(C(=O)N1c1ccc(cc1)F)Cc1ccc(cc1)F)/C#N

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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 C21H16F2N2O3S MW 414.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F2N2O3S/c1-2-28-21(27)17(12-24)20-25(16-9-7-15(23)8-10-16)19(26)18(29-20)11-13-3-5-14(22)6-4-13/h3-10,18H,2,11H2,1H3/b20-17-
InChIKey
IJJYNJAKUSWLSA-JZJYNLBNSA-N
Synonyms
786678-04-4
786678044
CCOC(=O)C(=C1N(C(=O)C(S1)CC2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C#N
CCOC(=O)C(=C1SC(C(=O)N1c1ccc(cc1)F)Cc1ccc(cc1)F)C#N
ETHYL(2Z)2CYANO2(3(4FLUOROPHENYL)5((4FLUOROPHENYL)METHYL)4OXO13THIAZOLIDIN2YLIDENE)ACETATE
ethyl(2Z)cyano(5(4fluorobenzyl)3(4fluorophenyl)4oxo13thiazolidin2ylidene)ethanoate
ETHYL2CYANO2(3(4FLUOROPHENYL)5((4FLUOROPHENYL)METHYL)4OXO(13THIAZOLIDIN2YLIDENE))ACETATE
InChI=1SC21H16F2N2O3Sc122821(27)17(1224)2025(169715(23)81016)19(26)18(2920)11133514(22)6413h31018H211H21H3b2017
MFCD06640748
ZINC000016758857
ZINC000016758860

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Available files

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