1-butyl-3-[(5-fluoranyl-2-methyl-phenyl)methyl]urea

Systemtic Name: 1-butyl-3-[(5-fluoranyl-2-methyl-phenyl)methyl]urea Openeye Name: 1-butyl-3-[(5-fluoro-2-methyl-phenyl)methyl]urea CAS Name: 1-butyl-3-[(5-fluoro-2-methylphenyl)methyl]urea IUPAC Name: 1-butyl-3-[(5-fluoro-2-methylphenyl)methyl]urea Traditional Name: 1-butyl-3-(5-fluoro-2-methyl-benzyl)urea Formula: C13H19FN2O MolecularWeight: 238.301163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NCC1=C(C=CC(=C1)F)C

Isomeric SMILES

CCCCNC(=O)NCC1=C(C=CC(=C1)F)C

InChI

InChI=1S/C13H19FN2O/c1-3-4-7-15-13(17)16-9-11-8-12(14)6-5-10(11)2/h5-6,8H,3-4,7,9H2,1-2H3,(H2,15,16,17)