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1-(4-fluorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phthalazine

1-(4-fluorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phthalazine

Systemtic Name:1-(4-fluorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phthalazine
Openeye Name:1-(4-fluorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phthalazine
CAS Name:1-(4-fluorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]phthalazine
IUPAC Name:1-(4-fluorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]phthalazine
Traditional Name:1-(4-fluorophenyl)-4-[(6-nitro-4H-1,3-benzodioxin-8-yl)methylthio]phthalazine
Formula: C23H16FN3O4S
MolecularWeight: 449.454243
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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NN=C(C4=CC=CC=C43)C5=CC=C(C=C5)F)[N+](=O)[O-]


Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NN=C(C4=CC=CC=C43)C5=CC=C(C=C5)F)[N+](=O)[O-]


InChI

InChI=1S/C23H16FN3O4S/c24-17-7-5-14(6-8-17)21-19-3-1-2-4-20(19)23(26-25-21)32-12-16-10-18(27(28)29)9-15-11-30-13-31-22(15)16/h1-10H,11-13H2


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