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

Systemtic Name: 1-[[2,5-bis(fluoranyl)phenyl]methyl]-3-butyl-urea Openeye Name: 1-butyl-3-[(2,5-difluorophenyl)methyl]urea CAS Name: 1-butyl-3-[(2,5-difluorophenyl)methyl]urea IUPAC Name: 1-butyl-3-[(2,5-difluorophenyl)methyl]urea Traditional Name: 1-butyl-3-(2,5-difluorobenzyl)urea Formula: C12H16F2N2O MolecularWeight: 242.265046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16F2N2O/c1-2-3-6-15-12(17)16-8-9-7-10(13)4-5-11(9)14/h4-5,7H,2-3,6,8H2,1H3,(H2,15,16,17)