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

Systemtic Name: 3-butyl-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-urea Openeye Name: 3-butyl-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentyl-urea CAS Name: 3-butyl-1-[[1-[(4-fluorophenyl)methyl]-2-pyrrolyl]methyl]-1-pentylurea IUPAC Name: 3-butyl-1-[[1-[(4-fluorophenyl)methyl]pyrrol-2-yl]methyl]-1-pentylurea Traditional Name: 1-amyl-3-butyl-1-[[1-(4-fluorobenzyl)pyrrol-2-yl]methyl]urea Formula: C22H32FN3O MolecularWeight: 373.507383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NCCCC

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=C(C=C2)F)C(=O)NCCCC

InChI

InChI=1S/C22H32FN3O/c1-3-5-7-15-26(22(27)24-14-6-4-2)18-21-9-8-16-25(21)17-19-10-12-20(23)13-11-19/h8-13,16H,3-7,14-15,17-18H2,1-2H3,(H,24,27)