3-[3-[[(2-azanyl-6-methyl-pyridin-3-yl)amino]methyl]-4-methoxy-phenyl]benzenecarbonitrile

Systemtic Name: 3-[3-[[(2-azanyl-6-methyl-pyridin-3-yl)amino]methyl]-4-methoxy-phenyl]benzenecarbonitrile Openeye Name: 3-[3-[[(2-amino-6-methyl-3-pyridyl)amino]methyl]-4-methoxy-phenyl]benzonitrile CAS Name: 3-[3-[[(2-amino-6-methyl-3-pyridinyl)amino]methyl]-4-methoxyphenyl]benzonitrile IUPAC Name: 3-[3-[[(2-amino-6-methylpyridin-3-yl)amino]methyl]-4-methoxyphenyl]benzonitrile Traditional Name: 3-[3-[[(2-amino-6-methyl-3-pyridyl)amino]methyl]-4-methoxy-phenyl]benzonitrile Formula: C21H20N4O MolecularWeight: 344.4097

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)NCC2=C(C=CC(=C2)C3=CC=CC(=C3)C#N)OC)N

Isomeric SMILES

CC1=NC(=C(C=C1)NCC2=C(C=CC(=C2)C3=CC=CC(=C3)C#N)OC)N

InChI

InChI=1S/C21H20N4O/c1-14-6-8-19(21(23)25-14)24-13-18-11-17(7-9-20(18)26-2)16-5-3-4-15(10-16)12-22/h3-11,24H,13H2,1-2H3,(H2,23,25)