N,N-dimethyl-4-[3-(2-pyridin-2-ylethynyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline

Systemtic Name: N,N-dimethyl-4-[3-(2-pyridin-2-ylethynyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline Openeye Name: N,N-dimethyl-4-[3-[2-(2-pyridyl)ethynyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline CAS Name: N,N-dimethyl-4-[3-[2-(2-pyridinyl)ethynyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline IUPAC Name: N,N-dimethyl-4-[3-(2-pyridin-2-ylethynyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]aniline Traditional Name: dimethyl-[4-[3-[2-(2-pyridyl)ethynyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]phenyl]amine Formula: C22H18N4 MolecularWeight: 338.40512

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CN=C3C(=C2)C(=CN3)C#CC4=CC=CC=N4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CN=C3C(=C2)C(=CN3)C#CC4=CC=CC=N4

InChI

InChI=1S/C22H18N4/c1-26(2)20-10-7-16(8-11-20)18-13-21-17(14-24-22(21)25-15-18)6-9-19-5-3-4-12-23-19/h3-5,7-8,10-15H,1-2H3,(H,24,25)