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

Systemtic Name: 2-azanyl-4-(5-bromanyl-2-ethoxy-phenyl)-6-(4-fluorophenyl)-5-methyl-pyridine-3-carbonitrile Openeye Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-6-(4-fluorophenyl)-5-methyl-pyridine-3-carbonitrile CAS Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-6-(4-fluorophenyl)-5-methyl-3-pyridinecarbonitrile IUPAC Name: 2-amino-4-(5-bromo-2-ethoxyphenyl)-6-(4-fluorophenyl)-5-methylpyridine-3-carbonitrile Traditional Name: 2-amino-4-(5-bromo-2-ethoxy-phenyl)-6-(4-fluorophenyl)-5-methyl-nicotinonitrile Formula: C21H17BrFN3O MolecularWeight: 426.281583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrFN3O/c1-3-27-18-9-6-14(22)10-16(18)19-12(2)20(26-21(25)17(19)11-24)13-4-7-15(23)8-5-13/h4-10H,3H2,1-2H3,(H2,25,26)