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(5E)-2-anilino-4-keto-5-[(phenethylamino)methylene]thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID DO6zWD8IRx3
InChI InChI=1S/C22H22N2O3S/c1-2-27-22(26)19-20(25)18(15-23-14-13-16-9-5-3-6-10-16)28-21(19)24-17-11-7-4-8-12-17/h3-12,15,23-24H,2,13-14H2,1H3/b18-15+
InChIKey IXYMADGFSMLOSJ-OBGWFSINSA-N
Mol Weight 394.49 g/mol
Molecular Formula C22H22N2O3S
Exact Mass 394.135114 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8S5uWo5buva
Name (5E)-2-anilino-4-keto-5-[(phenethylamino)methylene]thiophene-3-carboxylic acid ethyl ester
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Formula C22H22N2O3S
InChI InChI=1S/C22H22N2O3S/c1-2-27-22(26)19-20(25)18(15-23-14-13-16-9-5-3-6-10-16)28-21(19)24-17-11-7-4-8-12-17/h3-12,15,23-24H,2,13-14H2,1H3/b18-15+
InChIKey IXYMADGFSMLOSJ-OBGWFSINSA-N
Molecular Weight 394.489 g/mol
SMILES N(\C=C/1C(C(=C(S1)Nc1ccccc1)C(OCC)=O)=O)CCc1ccccc1
SPLASH splash10-0pbc-8489000000-2d3860db5aedd9899d1f
Synonyms Ethyl (5E)-2-anilino-4-oxo-5-[(phenethylamino)methylidene]thiophene-3-carboxylate Thiophene-3-carboxylic acid, 4-oxo-5-(phenethylaminomethylene)-2-phenylamino-4,5-dihydro-, ethyl ester (5E)-2-anilino-4-oxo-5-[(2-phenylethylamino)methylidene]-3-thiophenecarboxylic acid ethyl ester Ethyl (5E)-2-anilino-4-oxo-5-[(2-phenylethylamino)methylidene]thiophene-3-carboxylate Ethyl (5E)-2-anilino-4-oxo-5-[(2-phenylethylamino)methylene]thiophene-3-carboxylate
Wiley ID 1446819