3-bromanyl-N-[2-oxidanylidene-2-[[3-(2-thiophen-2-ylethynyl)phenyl]amino]ethyl]benzamide

Systemtic Name: 3-bromanyl-N-[2-oxidanylidene-2-[[3-(2-thiophen-2-ylethynyl)phenyl]amino]ethyl]benzamide Openeye Name: 3-bromo-N-[2-oxo-2-[3-[2-(2-thienyl)ethynyl]anilino]ethyl]benzamide CAS Name: 3-bromo-N-[2-oxo-2-[3-(2-thiophen-2-ylethynyl)anilino]ethyl]benzamide IUPAC Name: 3-bromo-N-[2-oxo-2-[3-(2-thiophen-2-ylethynyl)anilino]ethyl]benzamide Traditional Name: 3-bromo-N-[2-keto-2-[3-[2-(2-thienyl)ethynyl]anilino]ethyl]benzamide Formula: C21H15BrN2O2S MolecularWeight: 439.325

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)Br)C#CC3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CNC(=O)C2=CC(=CC=C2)Br)C#CC3=CC=CS3

InChI

InChI=1S/C21H15BrN2O2S/c22-17-6-2-5-16(13-17)21(26)23-14-20(25)24-18-7-1-4-15(12-18)9-10-19-8-3-11-27-19/h1-8,11-13H,14H2,(H,23,26)(H,24,25)