2-(3,4-dimethylphenyl)-6-fluoranyl-N-(phenylmethyl)quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-6-fluoranyl-N-(phenylmethyl)quinoline-4-carboxamide Openeye Name: N-benzyl-2-(3,4-dimethylphenyl)-6-fluoro-quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-6-fluoro-N-(phenylmethyl)-4-quinolinecarboxamide IUPAC Name: N-benzyl-2-(3,4-dimethylphenyl)-6-fluoroquinoline-4-carboxamide Traditional Name: N-benzyl-2-(3,4-dimethylphenyl)-6-fluoro-cinchoninamide Formula: C25H21FN2O MolecularWeight: 384.445443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(C=C(C=C3)F)C(=C2)C(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C25H21FN2O/c1-16-8-9-19(12-17(16)2)24-14-22(21-13-20(26)10-11-23(21)28-24)25(29)27-15-18-6-4-3-5-7-18/h3-14H,15H2,1-2H3,(H,27,29)