3,4-dicyclopropyl-5-[(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3,4-dicyclopropyl-5-[(6-fluoranyl-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3,4-dicyclopropyl-5-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,2,4-triazole CAS Name: 3,4-dicyclopropyl-5-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]-1,2,4-triazole IUPAC Name: 3,4-dicyclopropyl-5-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3,4-dicyclopropyl-5-[(6-fluoro-2-phenyl-4H-1,3-benzodioxin-8-yl)methylthio]-1,2,4-triazole Formula: C23H22FN3O2S MolecularWeight: 423.503083

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NN=C(N2C3CC3)SCC4=C5C(=CC(=C4)F)COC(O5)C6=CC=CC=C6

Isomeric SMILES

C1CC1C2=NN=C(N2C3CC3)SCC4=C5C(=CC(=C4)F)COC(O5)C6=CC=CC=C6

InChI

InChI=1S/C23H22FN3O2S/c24-18-10-16-12-28-22(15-4-2-1-3-5-15)29-20(16)17(11-18)13-30-23-26-25-21(14-6-7-14)27(23)19-8-9-19/h1-5,10-11,14,19,22H,6-9,12-13H2