6-chloranyl-N-[(1-ethylpyrazol-4-yl)methyl]-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-N-[(1-ethylpyrazol-4-yl)methyl]-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 6-chloro-N-[(1-ethylpyrazol-4-yl)methyl]-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 6-chloro-N-[(1-ethyl-4-pyrazolyl)methyl]-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-N-[(1-ethylpyrazol-4-yl)methyl]-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 6-chloro-N-[(1-ethylpyrazol-4-yl)methyl]-2-(3-pyridyl)cinchoninamide Formula: C21H18ClN5O MolecularWeight: 391.85352

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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=CN=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C21H18ClN5O/c1-2-27-13-14(11-25-27)10-24-21(28)18-9-20(15-4-3-7-23-12-15)26-19-6-5-16(22)8-17(18)19/h3-9,11-13H,2,10H2,1H3,(H,24,28)