Vitas-M small molecule compound
(5Z)-5-{4-[(4-bromobenzyl)oxy]-3-methoxybenzylidene}-3-(2-methoxyethyl)-2-thioxo-1,3-thiazolidin-4-one
Catalog ID
STL378302
SMILES COCCN1C(=S)S/C(=C\c2ccc(c(c2)OC)OCc2ccc(cc2)Br)/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 C21H20BrNO4S2 MW 494.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20BrNO4S2/c1-25-10-9-23-20(24)19(29-21(23)28)12-15-5-8-17(18(11-15)26-2)27-13-14-3-6-16(22)7-4-14/h3-8,11-12H,9-10,13H2,1-2H3/b19-12-InChIKey
XJUYLIXWPAQLRU-UNOMPAQXSA-NSynonyms
(5Z)5((4((4BROMOPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)3(2METHOXYETHYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(4((4bromobenzyl)oxy)3methoxybenzylidene)3(2methoxyethyl)2thioxo13thiazolidin4one
COCCN1C(=O)C(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)Br)OC)SC1=S
COCCN1C(=S)SC(=Cc2ccc(c(c2)OC)OCc2ccc(cc2)Br)C1=O
InChI=1SC21H20BrNO4S2c1251092320(24)19(2921(23)28)12155817(18(1115)262)2713143616(22)7414h381112H91013H212H3b1912
MFCD03705614
ZINC000002984675
ZINC02984675
ZINC2984675
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