Vitas-M small molecule compound

(5Z)-5-(4-tert-butylbenzylidene)-3-[(4-methylpiperidin-1-yl)methyl]-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STK082776
SMILES CC1CCN(CC1)CN1C(=S)S/C(=C\c2ccc(cc2)C(C)(C)C)/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 C21H28N2OS2 MW 388.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N2OS2/c1-15-9-11-22(12-10-15)14-23-19(24)18(26-20(23)25)13-16-5-7-17(8-6-16)21(2,3)4/h5-8,13,15H,9-12,14H2,1-4H3/b18-13-
InChIKey
UKVHWRWCXUNIMN-AQTBWJFISA-N
Synonyms

(5Z)5((4TERTBUTYLPHENYL)METHYLIDENE)3((4METHYLPIPERIDIN1YL)METHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(4TERTBUTYLBENZYLIDENE)3((4METHYLPIPERIDIN1YL)METHYL)2THIOXO13THIAZOLIDIN4ONE
(E)5(4(tertbutyl)benzylidene)3((4methylpiperidin1yl)methyl)2thioxothiazolidin4one
CC1CCN(CC1)CN1C(=S)SC(=Cc2ccc(cc2)C(C)(C)C)C1=O
CC1CCN(CC1)CN2C(=O)C(=CC3=CC=C(C=C3)C(C)(C)C)SC2=S
InChI=1SC21H28N2OS2c11591122(121015)142319(24)18(2620(23)25)13165717(8616)21(23)4h581315H91214H214H3b1813
MFCD01426762
STK082776
ZINC000020157621
ZINC20157621

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Available files

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