4-[(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]quinazoline

Systemtic Name: 4-[(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]quinazoline Openeye Name: 4-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]quinazoline CAS Name: 4-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]quinazoline IUPAC Name: 4-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]quinazoline Traditional Name: 4-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]quinazoline Formula: C23H17FN2O2S MolecularWeight: 404.456683

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)CSC4=NC=NC5=CC=CC=C54)F

Isomeric SMILES

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)CSC4=NC=NC5=CC=CC=C54)F

InChI

InChI=1S/C23H17FN2O2S/c24-18-10-16-12-27-23(15-6-2-1-3-7-15)28-21(16)17(11-18)13-29-22-19-8-4-5-9-20(19)25-14-26-22/h1-11,14,23H,12-13H2