N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-2-methyl-8-(4-methylphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-2-methyl-8-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-2-methyl-8-(p-tolyl)quinoline-4-carboxamide CAS Name: N-[3-[4-(2-fluorophenyl)-1-piperazinyl]propyl]-2-methyl-8-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-[4-(2-fluorophenyl)piperazin-1-yl]propyl]-2-methyl-8-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[3-[4-(2-fluorophenyl)piperazino]propyl]-2-methyl-8-(p-tolyl)cinchoninamide Formula: C31H33FN4O MolecularWeight: 496.618323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC=CC3=C2N=C(C=C3C(=O)NCCCN4CCN(CC4)C5=CC=CC=C5F)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC=CC3=C2N=C(C=C3C(=O)NCCCN4CCN(CC4)C5=CC=CC=C5F)C

InChI

InChI=1S/C31H33FN4O/c1-22-11-13-24(14-12-22)25-7-5-8-26-27(21-23(2)34-30(25)26)31(37)33-15-6-16-35-17-19-36(20-18-35)29-10-4-3-9-28(29)32/h3-5,7-14,21H,6,15-20H2,1-2H3,(H,33,37)