Vitas-M small molecule compound
(2E)-3-(4-butoxy-3-methoxyphenyl)-2-[(4-chlorophenyl)sulfonyl]prop-2-enenitrile
Catalog ID
STK816689
SMILES CCCCOc1ccc(cc1OC)/C=C(/S(=O)(=O)c1ccc(cc1)Cl)\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 C20H20ClNO4S MW 405.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClNO4S/c1-3-4-11-26-19-10-5-15(13-20(19)25-2)12-18(14-22)27(23,24)17-8-6-16(21)7-9-17/h5-10,12-13H,3-4,11H2,1-2H3/b18-12+InChIKey
AGPKYEYVTLTVHS-LDADJPATSA-NSynonyms
(2E)3(4butoxy3methoxyphenyl)2((4chlorophenyl)sulfonyl)prop2enenitrile
(E)3(4BUTOXY3METHOXYPHENYL)2(4CHLOROPHENYL)SULFONYLPROP2ENENITRILE
CCCCOC1=C(C=C(C=C1)C=C(C#N)S(=O)(=O)C2=CC=C(C=C2)Cl)OC
CCCCOc1ccc(cc1OC)C=C(S(=O)(=O)c1ccc(cc1)Cl)C#N
InChI=1SC20H20ClNO4Sc13411261910515(1320(19)252)1218(1422)27(2324)178616(21)7917h5101213H3411H212H3b1812+
MFCD03992007
ZINC000001915674
ZINC01915674
ZINC1915674
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