Vitas-M small molecule compound
2-bromo-6-methoxy-4-[(E)-(3-methyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)methyl]phenyl thiophene-2-carboxylate
Catalog ID
STK393914
SMILES COc1cc(/C=C\2/SC(=S)N(C2=O)C)cc(c1OC(=O)c1cccs1)Br
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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 C17H12BrNO4S3 MW 470.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12BrNO4S3/c1-19-15(20)13(26-17(19)24)8-9-6-10(18)14(11(7-9)22-2)23-16(21)12-4-3-5-25-12/h3-8H,1-2H3/b13-8+InChIKey
LUNICVKVCJQKAG-MDWZMJQESA-NSynonyms
(2BROMO6METHOXY4((E)(3METHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)METHYL)PHENYL)THIOPHENE2CARBOXYLATE
2bromo6methoxy4((E)(3methyl4oxo2thioxo13thiazolidin5ylidene)methyl)phenylthiophene2carboxylate
CN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OC(=O)C3=CC=CS3)OC)SC1=S
COc1cc(C=C2SC(=S)N(C2=O)C)cc(c1OC(=O)c1cccs1)Br
InChI=1SC17H12BrNO4S3c11915(20)13(2617(19)24)89610(18)14(11(79)222)2316(21)124352512h38H12H3b138+
MFCD03648983
ZINC000015012133
ZINC15012133
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