2-azanyl-4-(5-bromanyl-2-ethoxy-phenyl)-6-(4-phenoxyphenyl)pyridine-3-carbonitrile

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-ethoxy-phenyl)-6-(4-phenoxyphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-6-(4-phenoxyphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-6-(4-phenoxyphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-6-(4-phenoxyphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-6-(4-phenoxyphenyl)nicotinonitrile Formula: C26H20BrN3O2 MolecularWeight: 486.3599

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C2=CC(=NC(=C2C#N)N)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H20BrN3O2/c1-2-31-25-13-10-18(27)14-22(25)21-15-24(30-26(29)23(21)16-28)17-8-11-20(12-9-17)32-19-6-4-3-5-7-19/h3-15H,2H2,1H3,(H2,29,30)