ethyl (5Z)-2-benzamido-5-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-4-oxidanylidene-thiophene-3-carboxylate

Systemtic Name: ethyl (5Z)-2-benzamido-5-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-4-oxidanylidene-thiophene-3-carboxylate Openeye Name: ethyl (5Z)-2-benzamido-5-[[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]methylene]-4-oxo-thiophene-3-carboxylate CAS Name: (5Z)-2-benzamido-5-[[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-4-oxo-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl (5Z)-2-benzamido-5-[[3-bromo-4-[(4-fluorophenyl)methoxy]phenyl]methylidene]-4-oxothiophene-3-carboxylate Traditional Name: (5Z)-2-benzamido-5-[3-bromo-4-(4-fluorobenzyl)oxy-benzylidene]-4-keto-thiophene-3-carboxylic acid ethyl ester Formula: C28H21BrFNO5S MolecularWeight: 582.437443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=CC2=CC(=C(C=C2)OCC3=CC=C(C=C3)F)Br)C1=O)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(S/C(=C\C2=CC(=C(C=C2)OCC3=CC=C(C=C3)F)Br)/C1=O)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H21BrFNO5S/c1-2-35-28(34)24-25(32)23(37-27(24)31-26(33)19-6-4-3-5-7-19)15-18-10-13-22(21(29)14-18)36-16-17-8-11-20(30)12-9-17/h3-15H,2,16H2,1H3,(H,31,33)/b23-15-