Vitas-M small molecule compound

methyl 2-[(5E)-5-(3-bromo-5-chloro-4-methoxybenzylidene)-2,4-dioxo-1,3-thiazolidin-3-yl]propanoate

Catalog ID
STK154934
SMILES COC(=O)C(N1C(=O)S/C(=C/c2cc(Cl)c(c(c2)Br)OC)/C1=O)C

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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 C15H13BrClNO5S MW 434.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13BrClNO5S/c1-7(14(20)23-3)18-13(19)11(24-15(18)21)6-8-4-9(16)12(22-2)10(17)5-8/h4-7H,1-3H3/b11-6+
InChIKey
XRLVWWSTGMHDKB-IZZDOVSWSA-N
Synonyms

CC(C(=O)OC)N1C(=O)C(=CC2=CC(=C(C(=C2)Br)OC)Cl)SC1=O
COC(=O)C(N1C(=O)SC(=Cc2cc(Cl)c(c(c2)Br)OC)C1=O)C
InChI=1SC15H13BrClNO5Sc17(14(20)233)1813(19)11(2415(18)21)6849(16)12(222)10(17)58h47H13H3b116+
METHYL2((5E)5((3BROMO5CHLORO4METHOXYPHENYL)METHYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
METHYL2((5E)5(3BROMO5CHLORO4METHOXYBENZYLIDENE)24DIOXO13THIAZOLIDIN3YL)PROPANOATE
MFCD03721270
ZINC000009260949
ZINC000009260952

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Available files

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