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

Systemtic Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide Openeye Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide CAS Name: 2-(1-ethyl-5-methyl-4-pyrazolyl)-N-[(4-fluorophenyl)methyl]-4-quinolinecarboxamide IUPAC Name: 2-(1-ethyl-5-methylpyrazol-4-yl)-N-[(4-fluorophenyl)methyl]quinoline-4-carboxamide Traditional Name: 2-(1-ethyl-5-methyl-pyrazol-4-yl)-N-(4-fluorobenzyl)cinchoninamide Formula: C23H21FN4O MolecularWeight: 388.437443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)F)C

Isomeric SMILES

CCN1C(=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC=C(C=C4)F)C

InChI

InChI=1S/C23H21FN4O/c1-3-28-15(2)20(14-26-28)22-12-19(18-6-4-5-7-21(18)27-22)23(29)25-13-16-8-10-17(24)11-9-16/h4-12,14H,3,13H2,1-2H3,(H,25,29)