1-[4-[4-(phenylmethyl)piperidin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]-3-[2-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[4-[4-(phenylmethyl)piperidin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]-3-[2-(trifluoromethyl)phenyl]urea Openeye Name: 1-[4-(4-benzyl-1-piperidyl)-3-(pyrrolidine-1-carbonyl)phenyl]-3-[2-(trifluoromethyl)phenyl]urea CAS Name: 1-[3-[oxo(1-pyrrolidinyl)methyl]-4-[4-(phenylmethyl)-1-piperidinyl]phenyl]-3-[2-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[4-(4-benzylpiperidin-1-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-3-[2-(trifluoromethyl)phenyl]urea Traditional Name: 1-[4-(4-benzylpiperidino)-3-(pyrrolidine-1-carbonyl)phenyl]-3-[2-(trifluoromethyl)phenyl]urea Formula: C31H33F3N4O2 MolecularWeight: 550.61453

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)NC3=CC=CC=C3C(F)(F)F)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C31H33F3N4O2/c32-31(33,34)26-10-4-5-11-27(26)36-30(40)35-24-12-13-28(25(21-24)29(39)38-16-6-7-17-38)37-18-14-23(15-19-37)20-22-8-2-1-3-9-22/h1-5,8-13,21,23H,6-7,14-20H2,(H2,35,36,40)