Vitas-M small molecule compound
(5E)-5-(4-tert-butylbenzylidene)-3-(2-methoxyethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STK861638
SMILES COCCN1C(=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 C17H21NO2S2 MW 335.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21NO2S2/c1-17(2,3)13-7-5-12(6-8-13)11-14-15(19)18(9-10-20-4)16(21)22-14/h5-8,11H,9-10H2,1-4H3/b14-11+InChIKey
OJRQYQHHMVWUBC-SDNWHVSQSA-NSynonyms
(5E)5((4TERTBUTYLPHENYL)METHYLIDENE)3(2METHOXYETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5E)5(4tertbutylbenzylidene)3(2methoxyethyl)2thioxo13thiazolidin4one
CC(C)(C)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)S2)CCOC
COCCN1C(=S)SC(=Cc2ccc(cc2)C(C)(C)C)C1=O
InChI=1SC17H21NO2S2c117(23)137512(6813)111415(19)18(910204)16(21)2214h5811H910H214H3b1411+
MFCD01458566
ZINC000002677641
ZINC02677641
ZINC2677641
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