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

Systemtic Name: 1-cyclohexyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea Openeye Name: 1-cyclohexyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea CAS Name: 1-cyclohexyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]urea IUPAC Name: 1-cyclohexyl-3-(2-ethoxyphenyl)-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]urea Traditional Name: 1-cyclohexyl-1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-o-phenetyl-urea Formula: C27H32FN3O2 MolecularWeight: 449.560283

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)F)C4CCCCC4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)N(CC2=CC=CN2CC3=CC(=CC=C3)F)C4CCCCC4

InChI

InChI=1S/C27H32FN3O2/c1-2-33-26-16-7-6-15-25(26)29-27(32)31(23-12-4-3-5-13-23)20-24-14-9-17-30(24)19-21-10-8-11-22(28)18-21/h6-11,14-18,23H,2-5,12-13,19-20H2,1H3,(H,29,32)