[5-oxidanylidene-5-(thiophen-2-ylsulfonylamino)pentyl]-triphenyl-phosphanium bromide

Systemtic Name: [5-oxidanylidene-5-(thiophen-2-ylsulfonylamino)pentyl]-triphenyl-phosphanium bromide Openeye Name: [5-oxo-5-(2-thienylsulfonylamino)pentyl]-triphenyl-phosphonium bromide CAS Name: [5-oxo-5-(thiophen-2-ylsulfonylamino)pentyl]-triphenylphosphonium bromide IUPAC Name: [5-oxo-5-(thiophen-2-ylsulfonylamino)pentyl]-triphenylphosphanium bromide Traditional Name: [5-keto-5-(2-thienylsulfonylamino)pentyl]-triphenyl-phosphonium bromide Formula: C27H27BrNO3PS2 MolecularWeight: 588.515941

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[P+](CCCCC(=O)NS(=O)(=O)C2=CC=CS2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)[P+](CCCCC(=O)NS(=O)(=O)C2=CC=CS2)(C3=CC=CC=C3)C4=CC=CC=C4.[Br-]

InChI

InChI=1S/C27H26NO3PS2.BrH/c29-26(28-34(30,31)27-20-12-22-33-27)19-10-11-21-32(23-13-4-1-5-14-23,24-15-6-2-7-16-24)25-17-8-3-9-18-25;/h1-9,12-18,20,22H,10-11,19,21H2;1H