3-[3,5-bis(fluoranyl)phenyl]-1-cyclooctyl-1-(1-pyridin-3-ylethyl)urea

Systemtic Name: 3-[3,5-bis(fluoranyl)phenyl]-1-cyclooctyl-1-(1-pyridin-3-ylethyl)urea Openeye Name: 1-cyclooctyl-3-(3,5-difluorophenyl)-1-[1-(3-pyridyl)ethyl]urea CAS Name: 1-cyclooctyl-3-(3,5-difluorophenyl)-1-[1-(3-pyridinyl)ethyl]urea IUPAC Name: 1-cyclooctyl-3-(3,5-difluorophenyl)-1-(1-pyridin-3-ylethyl)urea Traditional Name: 1-cyclooctyl-3-(3,5-difluorophenyl)-1-[1-(3-pyridyl)ethyl]urea Formula: C22H27F2N3O MolecularWeight: 387.466086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)N(C2CCCCCCC2)C(=O)NC3=CC(=CC(=C3)F)F

Isomeric SMILES

CC(C1=CN=CC=C1)N(C2CCCCCCC2)C(=O)NC3=CC(=CC(=C3)F)F

InChI

InChI=1S/C22H27F2N3O/c1-16(17-8-7-11-25-15-17)27(21-9-5-3-2-4-6-10-21)22(28)26-20-13-18(23)12-19(24)14-20/h7-8,11-16,21H,2-6,9-10H2,1H3,(H,26,28)