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(5Z)-2-anilino-4-keto-5-[4-(trifluoromethyl)benzylidene]thiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID HqeW3oO77vt
InChI InChI=1S/C21H16F3NO3S/c1-2-28-20(27)17-18(26)16(29-19(17)25-15-6-4-3-5-7-15)12-13-8-10-14(11-9-13)21(22,23)24/h3-12,25H,2H2,1H3/b16-12-
InChIKey VOSKIXOMVVSEKZ-VBKFSLOCSA-N
Mol Weight 419.42 g/mol
Molecular Formula C21H16F3NO3S
Exact Mass 419.080299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3HS9k6HFA8C
Name (5Z)-2-anilino-4-keto-5-[4-(trifluoromethyl)benzylidene]thiophene-3-carboxylic acid ethyl ester
Alternate Name(s) (5Z)-2-anilino-4-oxo-5-[[4-(trifluoromethyl)phenyl]methylidene]-3-thiophenecarboxylic acid ethyl ester Ethyl (5Z)-2-anilino-4-oxo-5-[[4-(trifluoromethyl)phenyl]methylene]thiophene-3-carboxylate Ethyl (5Z)-2-anilino-4-oxo-5-[[4-(trifluoromethyl)phenyl]methylidene]thiophene-3-carboxylate Ethyl (5Z)-4-oxidanylidene-2-phenylazanyl-5-[[4-(trifluoromethyl)phenyl]methylidene]thiophene-3-carboxylate
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Formula C21H16F3NO3S
InChI InChI=1S/C21H16F3NO3S/c1-2-28-20(27)17-18(26)16(29-19(17)25-15-6-4-3-5-7-15)12-13-8-10-14(11-9-13)21(22,23)24/h3-12,25H,2H2,1H3/b16-12-
InChIKey VOSKIXOMVVSEKZ-VBKFSLOCSA-N
Molecular Weight 419.418 g/mol
SMILES N(C1=C(C(\C(S1)=C\c1ccc(cc1)C(F)(F)F)=O)C(OCC)=O)c1ccccc1
SPLASH splash10-0uk9-9885100000-af9c0fb5d0dd96be9c0a
Wiley ID 1454523