1-[2-(4-bromophenyl)ethyl]-1-piperidin-4-yl-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[2-(4-bromophenyl)ethyl]-1-piperidin-4-yl-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-[2-(4-bromophenyl)ethyl]-1-(4-piperidyl)-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-[2-(4-bromophenyl)ethyl]-1-(4-piperidinyl)-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[2-(4-bromophenyl)ethyl]-1-piperidin-4-yl-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-[2-(4-bromophenyl)ethyl]-1-(4-piperidyl)-3-[4-(trifluoromethyl)phenyl]urea Formula: C21H23BrF3N3O MolecularWeight: 470.32603

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1N(CCC2=CC=C(C=C2)Br)C(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CNCCC1N(CCC2=CC=C(C=C2)Br)C(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H23BrF3N3O/c22-17-5-1-15(2-6-17)11-14-28(19-9-12-26-13-10-19)20(29)27-18-7-3-16(4-8-18)21(23,24)25/h1-8,19,26H,9-14H2,(H,27,29)