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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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