N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(2-phenylpyrazol-3-yl)methyl]quinoline-4-carboxamide

Systemtic Name: N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(2-phenylpyrazol-3-yl)methyl]quinoline-4-carboxamide Openeye Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-N-[(2-phenylpyrazol-3-yl)methyl]quinoline-4-carboxamide CAS Name: N-[(2-chloro-4-fluorophenyl)methyl]-N-[(2-phenyl-3-pyrazolyl)methyl]-4-quinolinecarboxamide IUPAC Name: N-[(2-chloro-4-fluorophenyl)methyl]-N-[(2-phenylpyrazol-3-yl)methyl]quinoline-4-carboxamide Traditional Name: N-(2-chloro-4-fluoro-benzyl)-N-[(2-phenylpyrazol-3-yl)methyl]cinchoninamide Formula: C27H20ClFN4O MolecularWeight: 470.925303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=CC=N2)CN(CC3=C(C=C(C=C3)F)Cl)C(=O)C4=CC=NC5=CC=CC=C45

Isomeric SMILES

C1=CC=C(C=C1)N2C(=CC=N2)CN(CC3=C(C=C(C=C3)F)Cl)C(=O)C4=CC=NC5=CC=CC=C45

InChI

InChI=1S/C27H20ClFN4O/c28-25-16-20(29)11-10-19(25)17-32(18-22-12-15-31-33(22)21-6-2-1-3-7-21)27(34)24-13-14-30-26-9-5-4-8-23(24)26/h1-16H,17-18H2