1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-3-(phenylmethyl)urea

Systemtic Name: 1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-3-(phenylmethyl)urea Openeye Name: 3-benzyl-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-urea CAS Name: 1-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-1-pentyl-3-(phenylmethyl)urea IUPAC Name: 3-benzyl-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentylurea Traditional Name: 1-amyl-3-benzyl-1-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]urea Formula: C25H30FN3O MolecularWeight: 407.523603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H30FN3O/c1-2-3-7-16-29(25(30)27-18-21-9-5-4-6-10-21)20-24-11-8-17-28(24)19-22-12-14-23(26)15-13-22/h4-6,8-15,17H,2-3,7,16,18-20H2,1H3,(H,27,30)