N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[[2-(1-imidazolylmethyl)phenyl]methyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[[2-(imidazol-1-ylmethyl)phenyl]methyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[2-(imidazol-1-ylmethyl)benzyl]-2-(4-pyridyl)cinchoninamide Formula: C26H21N5O MolecularWeight: 419.47784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)CN5C=CN=C5

Isomeric SMILES

C1=CC=C(C(=C1)CNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4)CN5C=CN=C5

InChI

InChI=1S/C26H21N5O/c32-26(29-16-20-5-1-2-6-21(20)17-31-14-13-28-18-31)23-15-25(19-9-11-27-12-10-19)30-24-8-4-3-7-22(23)24/h1-15,18H,16-17H2,(H,29,32)