4-bromanyl-N-[3-oxidanylidene-3-[[3-(2-pyridin-2-ylethynyl)phenyl]amino]propyl]benzamide

Systemtic Name: 4-bromanyl-N-[3-oxidanylidene-3-[[3-(2-pyridin-2-ylethynyl)phenyl]amino]propyl]benzamide Openeye Name: 4-bromo-N-[3-oxo-3-[3-[2-(2-pyridyl)ethynyl]anilino]propyl]benzamide CAS Name: 4-bromo-N-[3-oxo-3-[3-[2-(2-pyridinyl)ethynyl]anilino]propyl]benzamide IUPAC Name: 4-bromo-N-[3-oxo-3-[3-(2-pyridin-2-ylethynyl)anilino]propyl]benzamide Traditional Name: 4-bromo-N-[3-keto-3-[3-[2-(2-pyridyl)ethynyl]anilino]propyl]benzamide Formula: C23H18BrN3O2 MolecularWeight: 448.31192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=NC(=C1)C#CC2=CC(=CC=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C23H18BrN3O2/c24-19-10-8-18(9-11-19)23(29)26-15-13-22(28)27-21-6-3-4-17(16-21)7-12-20-5-1-2-14-25-20/h1-6,8-11,14,16H,13,15H2,(H,26,29)(H,27,28)