Vitas-M small molecule compound
5-bromo-4-[(E)-2-cyano-2-(phenylsulfonyl)ethenyl]-2-ethoxyphenyl acetate
Catalog ID
STK481673
SMILES CCOc1cc(/C=C(/S(=O)(=O)c2ccccc2)\C#N)c(cc1OC(=O)C)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 C19H16BrNO5S MW 450.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrNO5S/c1-3-25-18-10-14(17(20)11-19(18)26-13(2)22)9-16(12-21)27(23,24)15-7-5-4-6-8-15/h4-11H,3H2,1-2H3/b16-9+InChIKey
ATJOUVUXXOKZIZ-CXUHLZMHSA-NSynonyms
(4((E)2(benzenesulfonyl)2cyanoethenyl)5bromo2ethoxyphenyl)acetate
5bromo4((E)2cyano2(phenylsulfonyl)ethenyl)2ethoxyphenylacetate
CCOC1=C(C=C(C(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)Br)OC(=O)C
CCOc1cc(C=C(S(=O)(=O)c2ccccc2)C#N)c(cc1OC(=O)C)Br
InChI=1SC19H16BrNO5Sc1325181014(17(20)1119(18)2613(2)22)916(1221)27(2324)157546815h411H3H212H3b169+
MFCD07048067
ZINC000013322237
ZINC13322237
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