1-quinolin-4-yl-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]urea

Systemtic Name: 1-quinolin-4-yl-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]urea Openeye Name: 1-(4-quinolyl)-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]urea CAS Name: 1-(4-quinolinyl)-3-[2-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]urea IUPAC Name: 1-quinolin-4-yl-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]urea Traditional Name: 1-(4-quinolyl)-3-[2-[4-[3-(trifluoromethyl)phenyl]piperazino]ethyl]urea Formula: C23H24F3N5O MolecularWeight: 443.46477

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)NC2=CC=NC3=CC=CC=C32)C4=CC=CC(=C4)C(F)(F)F

Isomeric SMILES

C1CN(CCN1CCNC(=O)NC2=CC=NC3=CC=CC=C32)C4=CC=CC(=C4)C(F)(F)F

InChI

InChI=1S/C23H24F3N5O/c24-23(25,26)17-4-3-5-18(16-17)31-14-12-30(13-15-31)11-10-28-22(32)29-21-8-9-27-20-7-2-1-6-19(20)21/h1-9,16H,10-15H2,(H2,27,28,29,32)