N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(1-phenyl-1,2,3-triazol-4-yl)methyl]quinoline-4-carboxamide

Systemtic Name: N-[(2-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(1-phenyl-1,2,3-triazol-4-yl)methyl]quinoline-4-carboxamide Openeye Name: N-[(2-chloro-4-fluoro-phenyl)methyl]-N-[(1-phenyltriazol-4-yl)methyl]quinoline-4-carboxamide CAS Name: N-[(2-chloro-4-fluorophenyl)methyl]-N-[(1-phenyl-4-triazolyl)methyl]-4-quinolinecarboxamide IUPAC Name: N-[(2-chloro-4-fluorophenyl)methyl]-N-[(1-phenyltriazol-4-yl)methyl]quinoline-4-carboxamide Traditional Name: N-(2-chloro-4-fluoro-benzyl)-N-[(1-phenyltriazol-4-yl)methyl]cinchoninamide Formula: C26H19ClFN5O MolecularWeight: 471.913363

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C26H19ClFN5O/c27-24-14-19(28)11-10-18(24)15-32(16-20-17-33(31-30-20)21-6-2-1-3-7-21)26(34)23-12-13-29-25-9-5-4-8-22(23)25/h1-14,17H,15-16H2