Vitas-M small molecule compound

(5Z)-5-[(2Z)-2-chloro-3-phenylprop-2-en-1-ylidene]-3-{2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoethyl}-1,3-thiazolidine-2,4-dione

Catalog ID
STK626826
SMILES OCCC1CCCCN1C(=O)CN1C(=O)S/C(=C\C(=C\c2ccccc2)\Cl)/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 C21H23ClN2O4S MW 434.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23ClN2O4S/c22-16(12-15-6-2-1-3-7-15)13-18-20(27)24(21(28)29-18)14-19(26)23-10-5-4-8-17(23)9-11-25/h1-3,6-7,12-13,17,25H,4-5,8-11,14H2/b16-12-,18-13-
InChIKey
ZFFGBMCATFBPQG-QKMFDWEGSA-N
Synonyms
902031-85-0
(5Z)5((2Z)2chloro3phenylprop2en1ylidene)3(2(2(2hydroxyethyl)piperidin1yl)2oxoethyl)13thiazolidine24dione
(5Z)5((Z)2CHLORO3PHENYLPROP2ENYLIDENE)3(2(2(2HYDROXYETHYL)PIPERIDIN1YL)2OXOETHYL)13THIAZOLIDINE24DIONE
(Z)5((Z)2chloro3phenylallylidene)3(2(2(2hydroxyethyl)piperidin1yl)2oxoethyl)thiazolidine24dione
5((2Z)2CHLORO3PHENYLPROP2ENYLIDENE)3(2(2(2HYDROXYETHYL)PIPERIDYL)2OXOETHYL)13THIAZOLIDINE24DIONE
902031850
C1CCN(C(C1)CCO)C(=O)CN2C(=O)C(=CC(=CC3=CC=CC=C3)Cl)SC2=O
InChI=1SC21H23ClN2O4Sc2216(12156213715)131820(27)24(21(28)2918)1419(26)231054817(23)91125h136712131725H4581114H2b16121813
MFCD06786129
OCCC1CCCCN1C(=O)CN1C(=O)SC(=CC(=Cc2ccccc2)Cl)C1=O
ZINC000009253196
ZINC000009253199

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Available files

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