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

Systemtic Name: 1-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-methoxyphenyl)urea Openeye Name: 1-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-methoxyphenyl)urea CAS Name: 1-butyl-1-[[1-[(3-fluorophenyl)methyl]-2-pyrrolyl]methyl]-3-(3-methoxyphenyl)urea IUPAC Name: 1-butyl-1-[[1-[(3-fluorophenyl)methyl]pyrrol-2-yl]methyl]-3-(3-methoxyphenyl)urea Traditional Name: 1-butyl-1-[[1-(3-fluorobenzyl)pyrrol-2-yl]methyl]-3-(3-methoxyphenyl)urea Formula: C24H28FN3O2 MolecularWeight: 409.496423

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H28FN3O2/c1-3-4-13-28(24(29)26-21-10-6-12-23(16-21)30-2)18-22-11-7-14-27(22)17-19-8-5-9-20(25)15-19/h5-12,14-16H,3-4,13,17-18H2,1-2H3,(H,26,29)