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

Systemtic Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-naphthalen-1-yl-1-pentyl-urea Openeye Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(1-naphthyl)-1-pentyl-urea CAS Name: 1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-3-(1-naphthalenyl)-1-pentylurea IUPAC Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-naphthalen-1-yl-1-pentylurea Traditional Name: 1-amyl-1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-(1-naphthyl)urea Formula: C28H30FN3O MolecularWeight: 443.555703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)NC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)NC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H30FN3O/c1-2-3-6-17-32(28(33)30-27-16-8-12-23-11-4-5-15-26(23)27)21-25-14-9-18-31(25)20-22-10-7-13-24(29)19-22/h4-5,7-16,18-19H,2-3,6,17,20-21H2,1H3,(H,30,33)