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(E)-5-(Ethoxycarbonylmethylidene)-1-(4-tolylsulfonyl)-3-(4-tolylsulfonylamino)-2,5-dihydropyrrol-2-one
SpectraBase Compound ID 2H48MOdQFXa
InChI InChI=1S/C22H22N2O7S2/c1-4-31-21(25)14-17-13-20(23-32(27,28)18-9-5-15(2)6-10-18)22(26)24(17)33(29,30)19-11-7-16(3)8-12-19/h5-14,23H,4H2,1-3H3/b17-14+
InChIKey CGDACPRJFKLSAP-SAPNQHFASA-N
Mol Weight 490.55 g/mol
Molecular Formula C22H22N2O7S2
Exact Mass 490.086843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fskFovl1E
Name (E)-5-(Ethoxycarbonylmethylidene)-1-(4-tolylsulfonyl)-3-(4-tolylsulfonylamino)-2,5-dihydropyrrol-2-one
Alternate Name(s) Ethyl (2E)-(1-[(4-methylphenyl)sulfonyl]-4-{[(4-methylphenyl)sulfonyl]amino}-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)ethanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O7S2
InChI InChI=1S/C22H22N2O7S2/c1-4-31-21(25)14-17-13-20(23-32(27,28)18-9-5-15(2)6-10-18)22(26)24(17)33(29,30)19-11-7-16(3)8-12-19/h5-14,23H,4H2,1-3H3/b17-14+
InChIKey CGDACPRJFKLSAP-SAPNQHFASA-N
Molecular Weight 490.545 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C=1C(N(S(c2ccc(cc2)C)(=O)=O)\C(C1)=C/C(=O)OCC)=O
SPLASH splash10-052f-9701200000-78ab43f1d524c3bae4b5
Source of Spectrum K1-2004-1908-14
Wiley ID 1560633