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

Systemtic Name: 1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-methylphenyl)-1-pentyl-urea Openeye Name: 1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(m-tolyl)-1-pentyl-urea CAS Name: 1-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-3-(3-methylphenyl)-1-pentylurea IUPAC Name: 1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-methylphenyl)-1-pentylurea Traditional Name: 1-amyl-1-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]-3-(m-tolyl)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)NC3=CC=CC(=C3)C

Isomeric SMILES

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

InChI

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