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

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-ethoxy-phenyl)-5-ethyl-6-phenyl-pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-5-ethyl-6-phenyl-pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-5-ethyl-6-phenyl-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-5-ethyl-6-phenyl-nicotinonitrile Formula: C22H20BrN3O MolecularWeight: 422.3177

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(C(=C1C2=C(C=CC(=C2)Br)OCC)C#N)N)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(N=C(C(=C1C2=C(C=CC(=C2)Br)OCC)C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C22H20BrN3O/c1-3-16-20(17-12-15(23)10-11-19(17)27-4-2)18(13-24)22(25)26-21(16)14-8-6-5-7-9-14/h5-12H,3-4H2,1-2H3,(H2,25,26)