3-(4-bromanyl-2-fluoranyl-phenyl)-1-methyl-1-pentyl-urea

Systemtic Name: 3-(4-bromanyl-2-fluoranyl-phenyl)-1-methyl-1-pentyl-urea Openeye Name: 3-(4-bromo-2-fluoro-phenyl)-1-methyl-1-pentyl-urea CAS Name: 3-(4-bromo-2-fluorophenyl)-1-methyl-1-pentylurea IUPAC Name: 3-(4-bromo-2-fluorophenyl)-1-methyl-1-pentylurea Traditional Name: 1-amyl-3-(4-bromo-2-fluoro-phenyl)-1-methyl-urea Formula: C13H18BrFN2O MolecularWeight: 317.197223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C)C(=O)NC1=C(C=C(C=C1)Br)F

Isomeric SMILES

CCCCCN(C)C(=O)NC1=C(C=C(C=C1)Br)F

InChI

InChI=1S/C13H18BrFN2O/c1-3-4-5-8-17(2)13(18)16-12-7-6-10(14)9-11(12)15/h6-7,9H,3-5,8H2,1-2H3,(H,16,18)