2-(4-acetamidophenyl)-6-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-acetamidophenyl)-6-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-4-carboxamide Openeye Name: 2-(4-acetamidophenyl)-6-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-4-carboxamide CAS Name: 2-(4-acetamidophenyl)-6-methyl-N-[3-(4-methyl-1-piperazinyl)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-acetamidophenyl)-6-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]quinoline-4-carboxamide Traditional Name: 2-(4-acetamidophenyl)-6-methyl-N-[3-(4-methylpiperazino)propyl]cinchoninamide Formula: C27H33N5O2 MolecularWeight: 459.58322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCCN3CCN(CC3)C)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCCN3CCN(CC3)C)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C27H33N5O2/c1-19-5-10-25-23(17-19)24(27(34)28-11-4-12-32-15-13-31(3)14-16-32)18-26(30-25)21-6-8-22(9-7-21)29-20(2)33/h5-10,17-18H,4,11-16H2,1-3H3,(H,28,34)(H,29,33)