Vitas-M small molecule compound
4-[(E)-2-cyano-2-(phenylsulfonyl)ethenyl]-2-ethoxyphenyl acetate
Catalog ID
STK445261
SMILES CCOc1cc(ccc1OC(=O)C)/C=C(/S(=O)(=O)c1ccccc1)\C#N
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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 C19H17NO5S MW 371.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17NO5S/c1-3-24-19-12-15(9-10-18(19)25-14(2)21)11-17(13-20)26(22,23)16-7-5-4-6-8-16/h4-12H,3H2,1-2H3/b17-11+InChIKey
BMCRJCRLHJMMLK-GZTJUZNOSA-NSynonyms
(4((E)2(benzenesulfonyl)2cyanoethenyl)2ethoxyphenyl)acetate
4((1E)2CYANO2(PHENYLSULFONYL)VINYL)2ETHOXYPHENYLACETATE
4((E)2cyano2(phenylsulfonyl)ethenyl)2ethoxyphenylacetate
CCOC1=C(C=CC(=C1)C=C(C#N)S(=O)(=O)C2=CC=CC=C2)OC(=O)C
CCOc1cc(ccc1OC(=O)C)C=C(S(=O)(=O)c1ccccc1)C#N
InChI=1SC19H17NO5Sc1324191215(91018(19)2514(2)21)1117(1320)26(2223)167546816h412H3H212H3b1711+
MFCD04057841
ZINC000006487484
ZINC06487484
ZINC6487484
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