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

Systemtic Name: 1-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-butyl-1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-butyl-1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-[4-(trifluoromethyl)phenyl]urea Formula: C24H25F4N3O MolecularWeight: 447.468413

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25F4N3O/c1-2-3-13-31(23(32)29-21-11-9-19(10-12-21)24(26,27)28)17-22-8-5-14-30(22)16-18-6-4-7-20(25)15-18/h4-12,14-15H,2-3,13,16-17H2,1H3,(H,29,32)