5-[2,6-bis(fluoranyl)phenyl]-2-phenylsulfanyl-pyrimido[1,6-b]pyridazin-6-one

Systemtic Name: 5-[2,6-bis(fluoranyl)phenyl]-2-phenylsulfanyl-pyrimido[1,6-b]pyridazin-6-one Openeye Name: 5-(2,6-difluorophenyl)-2-phenylsulfanyl-pyrimido[1,6-b]pyridazin-6-one CAS Name: 5-(2,6-difluorophenyl)-2-(phenylthio)-6-pyrimido[1,6-b]pyridazinone IUPAC Name: 5-(2,6-difluorophenyl)-2-phenylsulfanylpyrimido[1,6-b]pyridazin-6-one Traditional Name: 5-(2,6-difluorophenyl)-2-(phenylthio)pyrimido[1,6-b]pyridazin-6-one Formula: C19H11F2N3OS MolecularWeight: 367.371946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NN3C=NC(=O)C(=C3C=C2)C4=C(C=CC=C4F)F

Isomeric SMILES

C1=CC=C(C=C1)SC2=NN3C=NC(=O)C(=C3C=C2)C4=C(C=CC=C4F)F

InChI

InChI=1S/C19H11F2N3OS/c20-13-7-4-8-14(21)17(13)18-15-9-10-16(23-24(15)11-22-19(18)25)26-12-5-2-1-3-6-12/h1-11H