1-(4-fluorophenyl)-2-phenyl-3-phenylsulfanyl-pyrazolo[1,2-a]benzotriazol-10-ium-5-ide

Systemtic Name: 1-(4-fluorophenyl)-2-phenyl-3-phenylsulfanyl-pyrazolo[1,2-a]benzotriazol-10-ium-5-ide Openeye Name: 1-(4-fluorophenyl)-2-phenyl-3-phenylsulfanyl-pyrazolo[1,2-a]benzotriazol-10-ium-5-ide CAS Name: 1-(4-fluorophenyl)-2-phenyl-3-(phenylthio)pyrazolo[1,2-a]benzotriazol-10-ium-5-ide IUPAC Name: 1-(4-fluorophenyl)-2-phenyl-3-phenylsulfanylpyrazolo[1,2-a]benzotriazol-10-ium-5-ide Traditional Name: 1-(4-fluorophenyl)-2-phenyl-3-(phenylthio)pyrazolo[1,2-a]benzotriazol-10-ium-5-ide Formula: C27H18FN3S MolecularWeight: 435.515323

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N3[N-]C4=CC=CC=C4[N+]3=C2C5=CC=C(C=C5)F)SC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N3[N-]C4=CC=CC=C4[N+]3=C2C5=CC=C(C=C5)F)SC6=CC=CC=C6

InChI

InChI=1S/C27H18FN3S/c28-21-17-15-20(16-18-21)26-25(19-9-3-1-4-10-19)27(32-22-11-5-2-6-12-22)31-29-23-13-7-8-14-24(23)30(26)31/h1-18H