2-[3,4-bis[(4-methylpiperazin-1-yl)methyl]phenyl]-N-(2-morpholin-4-ylethyl)quinolin-4-amine

Systemtic Name: 2-[3,4-bis[(4-methylpiperazin-1-yl)methyl]phenyl]-N-(2-morpholin-4-ylethyl)quinolin-4-amine Openeye Name: 2-[3,4-bis[(4-methylpiperazin-1-yl)methyl]phenyl]-N-(2-morpholinoethyl)quinolin-4-amine CAS Name: 2-[3,4-bis[(4-methyl-1-piperazinyl)methyl]phenyl]-N-[2-(4-morpholinyl)ethyl]-4-quinolinamine IUPAC Name: 2-[3,4-bis[(4-methylpiperazin-1-yl)methyl]phenyl]-N-(2-morpholin-4-ylethyl)quinolin-4-amine Traditional Name: [2-[3,4-bis[(4-methylpiperazino)methyl]phenyl]-4-quinolyl]-(2-morpholinoethyl)amine Formula: C33H47N7O MolecularWeight: 557.77258

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=C(C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)NCCN5CCOCC5)CN6CCN(CC6)C

Isomeric SMILES

CN1CCN(CC1)CC2=C(C=C(C=C2)C3=NC4=CC=CC=C4C(=C3)NCCN5CCOCC5)CN6CCN(CC6)C

InChI

InChI=1S/C33H47N7O/c1-36-11-15-39(16-12-36)25-28-8-7-27(23-29(28)26-40-17-13-37(2)14-18-40)32-24-33(30-5-3-4-6-31(30)35-32)34-9-10-38-19-21-41-22-20-38/h3-8,23-24H,9-22,25-26H2,1-2H3,(H,34,35)