3-[2,4-bis(fluoranyl)phenyl]-1-(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-1-heptyl-urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-(8-bromanyl-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-1-heptyl-urea Openeye Name: 1-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3-(2,4-difluorophenyl)-1-heptyl-urea CAS Name: 1-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3-(2,4-difluorophenyl)-1-heptylurea IUPAC Name: 1-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3-(2,4-difluorophenyl)-1-heptylurea Traditional Name: 1-(8-bromo-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-3-(2,4-difluorophenyl)-1-heptyl-urea Formula: C24H29BrF2N2O2 MolecularWeight: 495.400066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(C1CCCOC2=C1C=CC(=C2)Br)C(=O)NC3=C(C=C(C=C3)F)F

Isomeric SMILES

CCCCCCCN(C1CCCOC2=C1C=CC(=C2)Br)C(=O)NC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C24H29BrF2N2O2/c1-2-3-4-5-6-13-29(24(30)28-21-12-10-18(26)16-20(21)27)22-8-7-14-31-23-15-17(25)9-11-19(22)23/h9-12,15-16,22H,2-8,13-14H2,1H3,(H,28,30)