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

Systemtic Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)-1-pentyl-urea Openeye Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)-1-pentyl-urea CAS Name: 1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-3-(4-nitrophenyl)-1-pentylurea IUPAC Name: 1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(4-nitrophenyl)-1-pentylurea Traditional Name: 1-amyl-1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-(4-nitrophenyl)urea Formula: C24H27FN4O3 MolecularWeight: 438.494583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC(=CC=C2)F)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H27FN4O3/c1-2-3-4-14-28(24(30)26-21-10-12-22(13-11-21)29(31)32)18-23-9-6-15-27(23)17-19-7-5-8-20(25)16-19/h5-13,15-16H,2-4,14,17-18H2,1H3,(H,26,30)