N-[5-bromanyl-2-[[4-(2-cyanophenyl)phenyl]methylamino]-4-methyl-pyridin-3-yl]pentanamide

Systemtic Name: N-[5-bromanyl-2-[[4-(2-cyanophenyl)phenyl]methylamino]-4-methyl-pyridin-3-yl]pentanamide Openeye Name: N-[5-bromo-2-[[4-(2-cyanophenyl)phenyl]methylamino]-4-methyl-3-pyridyl]pentanamide CAS Name: N-[5-bromo-2-[[4-(2-cyanophenyl)phenyl]methylamino]-4-methyl-3-pyridinyl]pentanamide IUPAC Name: N-[5-bromo-2-[[4-(2-cyanophenyl)phenyl]methylamino]-4-methylpyridin-3-yl]pentanamide Traditional Name: N-[5-bromo-2-[[4-(2-cyanophenyl)benzyl]amino]-4-methyl-3-pyridyl]valeramide Formula: C25H25BrN4O MolecularWeight: 477.3962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=CN=C1NCC2=CC=C(C=C2)C3=CC=CC=C3C#N)Br)C

Isomeric SMILES

CCCCC(=O)NC1=C(C(=CN=C1NCC2=CC=C(C=C2)C3=CC=CC=C3C#N)Br)C

InChI

InChI=1S/C25H25BrN4O/c1-3-4-9-23(31)30-24-17(2)22(26)16-29-25(24)28-15-18-10-12-19(13-11-18)21-8-6-5-7-20(21)14-27/h5-8,10-13,16H,3-4,9,15H2,1-2H3,(H,28,29)(H,30,31)