Vitas-M small molecule compound

2-bromo-4-{(E)-2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl}phenyl acetate

Catalog ID
STK898636
SMILES N#C/C(=C\c1ccc(c(c1)Br)OC(=O)C)/c1scc(n1)c1ccc(cc1)Cl

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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 C20H12BrClN2O2S MW 459.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12BrClN2O2S/c1-12(25)26-19-7-2-13(9-17(19)21)8-15(10-23)20-24-18(11-27-20)14-3-5-16(22)6-4-14/h2-9,11H,1H3/b15-8+
InChIKey
WIFVOZRJSIVWIM-OVCLIPMQSA-N
Synonyms

(2bromo4((E)2(4(4chlorophenyl)13thiazol2yl)2cyanoethenyl)phenyl)acetate
2bromo4((E)2(4(4chlorophenyl)13thiazol2yl)2cyanoethenyl)phenylacetate
CC(=O)OC1=C(C=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Cl)Br
InChI=1SC20H12BrClN2O2Sc112(25)26197213(917(19)21)815(1023)202418(112720)143516(22)6414h2911H1H3b158+
MFCD18173110
N#CC(=Cc1ccc(c(c1)Br)OC(=O)C)c1scc(n1)c1ccc(cc1)Cl
ZINC000044827446
ZINC44827446

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Available files

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