2-[4-(4-methylpiperazin-1-yl)phenyl]-N-(4-pyrrolidin-1-ylbutyl)quinolin-4-amine

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3)NCCCCN5CCCC5

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)C3=NC4=CC=CC=C4C(=C3)NCCCCN5CCCC5

InChI

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