N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-5-(3,5-dimethylphenyl)-2-pyridin-3-yl-pyridine-3-carboxamide

Systemtic Name: N-[(3-bromanyl-4-fluoranyl-phenyl)methyl]-5-(3,5-dimethylphenyl)-2-pyridin-3-yl-pyridine-3-carboxamide Openeye Name: N-[(3-bromo-4-fluoro-phenyl)methyl]-5-(3,5-dimethylphenyl)-2-(3-pyridyl)pyridine-3-carboxamide CAS Name: N-[(3-bromo-4-fluorophenyl)methyl]-5-(3,5-dimethylphenyl)-2-(3-pyridinyl)-3-pyridinecarboxamide IUPAC Name: N-[(3-bromo-4-fluorophenyl)methyl]-5-(3,5-dimethylphenyl)-2-pyridin-3-ylpyridine-3-carboxamide Traditional Name: N-(3-bromo-4-fluoro-benzyl)-5-(3,5-dimethylphenyl)-2-(3-pyridyl)nicotinamide Formula: C26H21BrFN3O MolecularWeight: 490.366843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C2=CC(=C(N=C2)C3=CN=CC=C3)C(=O)NCC4=CC(=C(C=C4)F)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)C2=CC(=C(N=C2)C3=CN=CC=C3)C(=O)NCC4=CC(=C(C=C4)F)Br)C

InChI

InChI=1S/C26H21BrFN3O/c1-16-8-17(2)10-20(9-16)21-12-22(25(30-15-21)19-4-3-7-29-14-19)26(32)31-13-18-5-6-24(28)23(27)11-18/h3-12,14-15H,13H2,1-2H3,(H,31,32)