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

Systemtic Name: N-(3-imidazol-1-ylpropyl)-2-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]quinolin-4-amine Openeye Name: N-(3-imidazol-1-ylpropyl)-2-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]quinolin-4-amine CAS Name: N-[3-(1-imidazolyl)propyl]-2-[3-[(4-methyl-1-piperazinyl)methyl]phenyl]-4-quinolinamine IUPAC Name: N-(3-imidazol-1-ylpropyl)-2-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]quinolin-4-amine Traditional Name: 3-imidazol-1-ylpropyl-[2-[3-[(4-methylpiperazino)methyl]phenyl]-4-quinolyl]amine Formula: C27H32N6 MolecularWeight: 440.58318

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=CC(=C2)C3=NC4=CC=CC=C4C(=C3)NCCCN5C=CN=C5

Isomeric SMILES

CN1CCN(CC1)CC2=CC=CC(=C2)C3=NC4=CC=CC=C4C(=C3)NCCCN5C=CN=C5

InChI

InChI=1S/C27H32N6/c1-31-14-16-32(17-15-31)20-22-6-4-7-23(18-22)26-19-27(24-8-2-3-9-25(24)30-26)29-10-5-12-33-13-11-28-21-33/h2-4,6-9,11,13,18-19,21H,5,10,12,14-17,20H2,1H3,(H,29,30)