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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C25H30FN3O/c1-3-4-5-16-29(25(30)27-23-14-8-20(2)9-15-23)19-24-7-6-17-28(24)18-21-10-12-22(26)13-11-21/h6-15,17H,3-5,16,18-19H2,1-2H3,(H,27,30)