6-[(2-bromanyl-3-methyl-phenyl)amino]-N-[(4-fluorophenyl)methyl]-4-propan-2-yl-pyridine-3-carboxamide

Systemtic Name: 6-[(2-bromanyl-3-methyl-phenyl)amino]-N-[(4-fluorophenyl)methyl]-4-propan-2-yl-pyridine-3-carboxamide Openeye Name: 6-(2-bromo-3-methyl-anilino)-N-[(4-fluorophenyl)methyl]-4-isopropyl-pyridine-3-carboxamide CAS Name: 6-(2-bromo-3-methylanilino)-N-[(4-fluorophenyl)methyl]-4-propan-2-yl-3-pyridinecarboxamide IUPAC Name: 6-(2-bromo-3-methylanilino)-N-[(4-fluorophenyl)methyl]-4-propan-2-ylpyridine-3-carboxamide Traditional Name: 6-(2-bromo-3-methyl-anilino)-N-(4-fluorobenzyl)-4-isopropyl-nicotinamide Formula: C23H23BrFN3O MolecularWeight: 456.350623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC2=NC=C(C(=C2)C(C)C)C(=O)NCC3=CC=C(C=C3)F)Br

Isomeric SMILES

CC1=C(C(=CC=C1)NC2=NC=C(C(=C2)C(C)C)C(=O)NCC3=CC=C(C=C3)F)Br

InChI

InChI=1S/C23H23BrFN3O/c1-14(2)18-11-21(28-20-6-4-5-15(3)22(20)24)26-13-19(18)23(29)27-12-16-7-9-17(25)10-8-16/h4-11,13-14H,12H2,1-3H3,(H,26,28)(H,27,29)