6-chloranyl-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: 6-chloro-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: 6-chloro-N-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: 6-chloro-N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: 6-chloro-N-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-2-(4-pyridyl)cinchoninamide Formula: C22H20ClN5O MolecularWeight: 405.8801

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=NC=C4)C

Isomeric SMILES

CCN1C(=C(C=N1)CNC(=O)C2=CC(=NC3=C2C=C(C=C3)Cl)C4=CC=NC=C4)C

InChI

InChI=1S/C22H20ClN5O/c1-3-28-14(2)16(13-26-28)12-25-22(29)19-11-21(15-6-8-24-9-7-15)27-20-5-4-17(23)10-18(19)20/h4-11,13H,3,12H2,1-2H3,(H,25,29)