1-[(4-piperidin-1-ylsulfonylphenyl)methyl]-3-[[2-(trifluoromethyloxy)phenyl]methyl]urea

Systemtic Name: 1-[(4-piperidin-1-ylsulfonylphenyl)methyl]-3-[[2-(trifluoromethyloxy)phenyl]methyl]urea Openeye Name: 1-[[4-(1-piperidylsulfonyl)phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea CAS Name: 1-[[4-(1-piperidinylsulfonyl)phenyl]methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea IUPAC Name: 1-[(4-piperidin-1-ylsulfonylphenyl)methyl]-3-[[2-(trifluoromethoxy)phenyl]methyl]urea Traditional Name: 1-(4-piperidinosulfonylbenzyl)-3-[2-(trifluoromethoxy)benzyl]urea Formula: C21H24F3N3O4S MolecularWeight: 471.49317

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)NCC3=CC=CC=C3OC(F)(F)F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC(=O)NCC3=CC=CC=C3OC(F)(F)F

InChI

InChI=1S/C21H24F3N3O4S/c22-21(23,24)31-19-7-3-2-6-17(19)15-26-20(28)25-14-16-8-10-18(11-9-16)32(29,30)27-12-4-1-5-13-27/h2-3,6-11H,1,4-5,12-15H2,(H2,25,26,28)