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(5E)-2-(3-chloroanilino)-4-keto-5-p-anisylidene-thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID 7D2mrMojsVq
InChI InChI=1S/C21H18ClNO4S/c1-3-27-21(25)18-19(24)17(11-13-7-9-16(26-2)10-8-13)28-20(18)23-15-6-4-5-14(22)12-15/h4-12,23H,3H2,1-2H3/b17-11+
InChIKey FCCFVZOJKZKLNB-GZTJUZNOSA-N
Mol Weight 415.89 g/mol
Molecular Formula C21H18ClNO4S
Exact Mass 415.064507 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hGuioVnk9G
Name (5E)-2-(3-chloroanilino)-4-keto-5-p-anisylidene-thiophene-3-carboxylic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18ClNO4S
InChI InChI=1S/C21H18ClNO4S/c1-3-27-21(25)18-19(24)17(11-13-7-9-16(26-2)10-8-13)28-20(18)23-15-6-4-5-14(22)12-15/h4-12,23H,3H2,1-2H3/b17-11+
InChIKey FCCFVZOJKZKLNB-GZTJUZNOSA-N
Molecular Weight 415.891 g/mol
SMILES N(C1=C(C(\C(S1)=C/c1ccc(cc1)OC)=O)C(OCC)=O)c1cc(ccc1)Cl
SPLASH splash10-03di-3901000000-681ca818c069783a6af2
Synonyms (5E)-2-(3-chloroanilino)-5-[(4-methoxyphenyl)methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester Ethyl (5E)-2-(3-chloroanilino)-5-[(4-methoxyphenyl)methylene]-4-oxo-thiophene-3-carboxylate Ethyl (5E)-2-(3-chloroanilino)-5-[(4-methoxyphenyl)methylidene]-4-oxothiophene-3-carboxylate Ethyl (5E)-2-[(3-chlorophenyl)amino]-5-[(4-methoxyphenyl)methylidene]-4-oxidanylidene-thiophene-3-carboxylate Ethyl 2-(3-chloroanilino)-5-(4-methoxybenzylidene)-4-oxo-4,5-dihydro-3-thiophenecarboxylate
Wiley ID 1446982