1-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]urea

Systemtic Name: 1-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]urea Openeye Name: 1-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methylpiperazin-1-yl)-6-quinolyl]urea CAS Name: 1-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methyl-1-piperazinyl)-6-quinolinyl]urea IUPAC Name: 1-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methylpiperazin-1-yl)quinolin-6-yl]urea Traditional Name: 1-(4-fluorobenzyl)-3-[4-methyl-2-(4-methylpiperazino)-6-quinolyl]urea Formula: C23H26FN5O MolecularWeight: 407.483843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)F)N4CCN(CC4)C

Isomeric SMILES

CC1=CC(=NC2=C1C=C(C=C2)NC(=O)NCC3=CC=C(C=C3)F)N4CCN(CC4)C

InChI

InChI=1S/C23H26FN5O/c1-16-13-22(29-11-9-28(2)10-12-29)27-21-8-7-19(14-20(16)21)26-23(30)25-15-17-3-5-18(24)6-4-17/h3-8,13-14H,9-12,15H2,1-2H3,(H2,25,26,30)