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

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-ethoxy-phenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-6-(4-propylphenyl)-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-6-(4-propylphenyl)pyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-6-(4-propylphenyl)nicotinonitrile Formula: C23H22BrN3O MolecularWeight: 436.34428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=C(C=CC(=C3)Br)OCC)C#N)N

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=C(C=CC(=C3)Br)OCC)C#N)N

InChI

InChI=1S/C23H22BrN3O/c1-3-5-15-6-8-16(9-7-15)21-13-18(20(14-25)23(26)27-21)19-12-17(24)10-11-22(19)28-4-2/h6-13H,3-5H2,1-2H3,(H2,26,27)