(2,3-dithiophen-2-ylphenyl)sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (2,3-dithiophen-2-ylphenyl)sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: [2,3-bis(2-thienyl)phenyl]sulfonium; trifluoromethanesulfonate CAS Name: (2,3-dithiophen-2-ylphenyl)sulfonium; trifluoromethanesulfonate IUPAC Name: (2,3-dithiophen-2-ylphenyl)sulfanium; trifluoromethanesulfonate Traditional Name: [2,3-bis(2-thienyl)phenyl]sulfonium triflate Formula: C15H11F3O3S4 MolecularWeight: 424.50125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)[SH2+])C2=CC=CS2)C3=CC=CS3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=C(C(=C1)[SH2+])C2=CC=CS2)C3=CC=CS3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C14H10S3.CHF3O3S/c15-11-5-1-4-10(12-6-2-8-16-12)14(11)13-7-3-9-17-13;2-1(3,4)8(5,6)7/h1-9,15H;(H,5,6,7)