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

Systemtic Name: 2-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-N-(3-pyrrolidin-1-ylpropyl)quinolin-4-amine Openeye Name: 2-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-N-(3-pyrrolidin-1-ylpropyl)quinolin-4-amine CAS Name: 2-[3-[(4-methyl-1-piperazinyl)methyl]phenyl]-N-[3-(1-pyrrolidinyl)propyl]-4-quinolinamine IUPAC Name: 2-[3-[(4-methylpiperazin-1-yl)methyl]phenyl]-N-(3-pyrrolidin-1-ylpropyl)quinolin-4-amine Traditional Name: [2-[3-[(4-methylpiperazino)methyl]phenyl]-4-quinolyl]-(3-pyrrolidinopropyl)amine Formula: C28H37N5 MolecularWeight: 443.62688

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=CC(=C2)C3=NC4=CC=CC=C4C(=C3)NCCCN5CCCC5

Isomeric SMILES

CN1CCN(CC1)CC2=CC=CC(=C2)C3=NC4=CC=CC=C4C(=C3)NCCCN5CCCC5

InChI

InChI=1S/C28H37N5/c1-31-16-18-33(19-17-31)22-23-8-6-9-24(20-23)27-21-28(25-10-2-3-11-26(25)30-27)29-12-7-15-32-13-4-5-14-32/h2-3,6,8-11,20-21H,4-5,7,12-19,22H2,1H3,(H,29,30)