2-azanyl-6-(2,5-dimethylphenyl)-4-(4-phenylmethoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-6-(2,5-dimethylphenyl)-4-(4-phenylmethoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(4-benzyloxyphenyl)-6-(2,5-dimethylphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-6-(2,5-dimethylphenyl)-4-(4-phenylmethoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-6-(2,5-dimethylphenyl)-4-(4-phenylmethoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(4-benzoxyphenyl)-6-(2,5-dimethylphenyl)nicotinonitrile Formula: C27H23N3O MolecularWeight: 405.49102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NC(=C(C(=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C#N)N

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NC(=C(C(=C2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C#N)N

InChI

InChI=1S/C27H23N3O/c1-18-8-9-19(2)23(14-18)26-15-24(25(16-28)27(29)30-26)21-10-12-22(13-11-21)31-17-20-6-4-3-5-7-20/h3-15H,17H2,1-2H3,(H2,29,30)