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

Systemtic Name: 8-(4-fluorophenyl)-2-methyl-N-[3-(4-propylpiperazin-1-yl)propyl]quinoline-4-carboxamide Openeye Name: 8-(4-fluorophenyl)-2-methyl-N-[3-(4-propylpiperazin-1-yl)propyl]quinoline-4-carboxamide CAS Name: 8-(4-fluorophenyl)-2-methyl-N-[3-(4-propyl-1-piperazinyl)propyl]-4-quinolinecarboxamide IUPAC Name: 8-(4-fluorophenyl)-2-methyl-N-[3-(4-propylpiperazin-1-yl)propyl]quinoline-4-carboxamide Traditional Name: 8-(4-fluorophenyl)-2-methyl-N-[3-(4-propylpiperazino)propyl]cinchoninamide Formula: C27H33FN4O MolecularWeight: 448.575523

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)CCCNC(=O)C2=CC(=NC3=C2C=CC=C3C4=CC=C(C=C4)F)C

Isomeric SMILES

CCCN1CCN(CC1)CCCNC(=O)C2=CC(=NC3=C2C=CC=C3C4=CC=C(C=C4)F)C

InChI

InChI=1S/C27H33FN4O/c1-3-13-31-15-17-32(18-16-31)14-5-12-29-27(33)25-19-20(2)30-26-23(6-4-7-24(25)26)21-8-10-22(28)11-9-21/h4,6-11,19H,3,5,12-18H2,1-2H3,(H,29,33)