1-butyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea

Systemtic Name: 1-butyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-butyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea CAS Name: 1-butyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-butyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-butyl-1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-o-phenetyl-urea Formula: C25H30FN3O2 MolecularWeight: 423.523003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)NC3=CC=CC=C3OCC

Isomeric SMILES

CCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)NC3=CC=CC=C3OCC

InChI

InChI=1S/C25H30FN3O2/c1-3-5-15-29(25(30)27-23-13-6-7-14-24(23)31-4-2)19-22-12-9-16-28(22)18-20-10-8-11-21(26)17-20/h6-14,16-17H,3-5,15,18-19H2,1-2H3,(H,27,30)