1-[[2,6-bis(fluoranyl)phenyl]methyl]-3-(4-chlorophenyl)-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]urea

Systemtic Name: 1-[[2,6-bis(fluoranyl)phenyl]methyl]-3-(4-chlorophenyl)-1-[3-[4-(phenylmethyl)piperidin-1-yl]propyl]urea Openeye Name: 1-[3-(4-benzyl-1-piperidyl)propyl]-3-(4-chlorophenyl)-1-[(2,6-difluorophenyl)methyl]urea CAS Name: 3-(4-chlorophenyl)-1-[(2,6-difluorophenyl)methyl]-1-[3-[4-(phenylmethyl)-1-piperidinyl]propyl]urea IUPAC Name: 1-[3-(4-benzylpiperidin-1-yl)propyl]-3-(4-chlorophenyl)-1-[(2,6-difluorophenyl)methyl]urea Traditional Name: 1-[3-(4-benzylpiperidino)propyl]-3-(4-chlorophenyl)-1-(2,6-difluorobenzyl)urea Formula: C29H32ClF2N3O MolecularWeight: 512.033686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCCN(CC3=C(C=CC=C3F)F)C(=O)NC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCCN(CC3=C(C=CC=C3F)F)C(=O)NC4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H32ClF2N3O/c30-24-10-12-25(13-11-24)33-29(36)35(21-26-27(31)8-4-9-28(26)32)17-5-16-34-18-14-23(15-19-34)20-22-6-2-1-3-7-22/h1-4,6-13,23H,5,14-21H2,(H,33,36)