3-[2,4-bis(fluoranyl)phenyl]-1-heptyl-1-(5-pyrimidin-2-ylsulfanylpentyl)urea

Systemtic Name: 3-[2,4-bis(fluoranyl)phenyl]-1-heptyl-1-(5-pyrimidin-2-ylsulfanylpentyl)urea Openeye Name: 3-(2,4-difluorophenyl)-1-heptyl-1-(5-pyrimidin-2-ylsulfanylpentyl)urea CAS Name: 3-(2,4-difluorophenyl)-1-heptyl-1-[5-(2-pyrimidinylthio)pentyl]urea IUPAC Name: 3-(2,4-difluorophenyl)-1-heptyl-1-(5-pyrimidin-2-ylsulfanylpentyl)urea Traditional Name: 3-(2,4-difluorophenyl)-1-heptyl-1-[5-(2-pyrimidylthio)pentyl]urea Formula: C23H32F2N4OS MolecularWeight: 450.588186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN(CCCCCSC1=NC=CC=N1)C(=O)NC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCCCCCCN(CCCCCSC1=NC=CC=N1)C(=O)NC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C23H32F2N4OS/c1-2-3-4-5-7-15-29(23(30)28-21-12-11-19(24)18-20(21)25)16-8-6-9-17-31-22-26-13-10-14-27-22/h10-14,18H,2-9,15-17H2,1H3,(H,28,30)