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

Systemtic Name: 2-[(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazole Openeye Name: 2-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazole CAS Name: 2-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazole IUPAC Name: 2-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazole Traditional Name: 2-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazole Formula: C17H13FN2O2S2 MolecularWeight: 360.425723

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)CSC4=NN=CS4)F

Isomeric SMILES

C1C2=CC(=CC(=C2OC(O1)C3=CC=CC=C3)CSC4=NN=CS4)F

InChI

InChI=1S/C17H13FN2O2S2/c18-14-6-12-8-21-16(11-4-2-1-3-5-11)22-15(12)13(7-14)9-23-17-20-19-10-24-17/h1-7,10,16H,8-9H2