N-[(3-bromophenyl)methyl]-5-(3,5-dimethylphenyl)-2-pyridin-3-yl-pyridine-3-carboxamide

Systemtic Name: N-[(3-bromophenyl)methyl]-5-(3,5-dimethylphenyl)-2-pyridin-3-yl-pyridine-3-carboxamide Openeye Name: N-[(3-bromophenyl)methyl]-5-(3,5-dimethylphenyl)-2-(3-pyridyl)pyridine-3-carboxamide CAS Name: N-[(3-bromophenyl)methyl]-5-(3,5-dimethylphenyl)-2-(3-pyridinyl)-3-pyridinecarboxamide IUPAC Name: N-[(3-bromophenyl)methyl]-5-(3,5-dimethylphenyl)-2-pyridin-3-ylpyridine-3-carboxamide Traditional Name: N-(3-bromobenzyl)-5-(3,5-dimethylphenyl)-2-(3-pyridyl)nicotinamide Formula: C26H22BrN3O MolecularWeight: 472.37638

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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(=CC=C4)Br)C

Isomeric SMILES

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

InChI

InChI=1S/C26H22BrN3O/c1-17-9-18(2)11-21(10-17)22-13-24(25(29-16-22)20-6-4-8-28-15-20)26(31)30-14-19-5-3-7-23(27)12-19/h3-13,15-16H,14H2,1-2H3,(H,30,31)