2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-N-[3-(4-methylpiperazin-1-yl)propyl]quinolin-4-amine

Systemtic Name: 2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-N-[3-(4-methylpiperazin-1-yl)propyl]quinolin-4-amine Openeye Name: 2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-N-[3-(4-methylpiperazin-1-yl)propyl]quinolin-4-amine CAS Name: 2-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]-N-[3-(4-methyl-1-piperazinyl)propyl]-4-quinolinamine IUPAC Name: 2-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-N-[3-(4-methylpiperazin-1-yl)propyl]quinolin-4-amine Traditional Name: [2-[4-[(4-methylpiperazino)methyl]phenyl]-4-quinolyl]-[3-(4-methylpiperazino)propyl]amine Formula: C29H40N6 MolecularWeight: 472.6681

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCNC2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CN5CCN(CC5)C

Isomeric SMILES

CN1CCN(CC1)CCCNC2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)CN5CCN(CC5)C

InChI

InChI=1S/C29H40N6/c1-32-14-18-34(19-15-32)13-5-12-30-29-22-28(31-27-7-4-3-6-26(27)29)25-10-8-24(9-11-25)23-35-20-16-33(2)17-21-35/h3-4,6-11,22H,5,12-21,23H2,1-2H3,(H,30,31)