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

Systemtic Name: N-cycloheptyl-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-cycloheptyl-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]quinoline-4-carboxamide CAS Name: N-cycloheptyl-2-[1-(4-fluorophenyl)-5-methyl-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-cycloheptyl-2-[1-(4-fluorophenyl)-5-methylpyrazol-4-yl]quinoline-4-carboxamide Traditional Name: N-cycloheptyl-2-[1-(4-fluorophenyl)-5-methyl-pyrazol-4-yl]cinchoninamide Formula: C27H27FN4O MolecularWeight: 442.527883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=C(C=C2)F)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5CCCCCC5

Isomeric SMILES

CC1=C(C=NN1C2=CC=C(C=C2)F)C3=NC4=CC=CC=C4C(=C3)C(=O)NC5CCCCCC5

InChI

InChI=1S/C27H27FN4O/c1-18-24(17-29-32(18)21-14-12-19(28)13-15-21)26-16-23(22-10-6-7-11-25(22)31-26)27(33)30-20-8-4-2-3-5-9-20/h6-7,10-17,20H,2-5,8-9H2,1H3,(H,30,33)