Vitas-M small molecule compound

methyl [(5Z)-5-(3-bromo-4-hydroxy-5-methoxybenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]acetate

Catalog ID
STL331101
SMILES COC(=O)CN1C(=S)S/C(=C\c2cc(Br)c(c(c2)OC)O)/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 C14H12BrNO5S2 MW 418.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H12BrNO5S2/c1-20-9-4-7(3-8(15)12(9)18)5-10-13(19)16(14(22)23-10)6-11(17)21-2/h3-5,18H,6H2,1-2H3/b10-5-
InChIKey
MSFIDAOGTXQGGE-YHYXMXQVSA-N
Synonyms
307538-68-7
(Z)methyl2(5(3bromo4hydroxy5methoxybenzylidene)4oxo2thioxothiazolidin3yl)acetate
307538687
COC(=O)CN1C(=S)SC(=Cc2cc(Br)c(c(c2)OC)O)C1=O
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)S2)CC(=O)OC)Br)O
InChI=1SC14H12BrNO5S2c120947(38(15)12(9)18)51013(19)16(14(22)2310)611(17)212h3518H6H212H3b105
methyl((5Z)5(3bromo4hydroxy5methoxybenzylidene)4oxo2thioxo13thiazolidin3yl)acetate
METHYL2((5Z)5((3BROMO4HYDROXY5METHOXYPHENYL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)ACETATE
MFCD02999382
ZINC000001213363
ZINC01213363
ZINC1213363

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Available files

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