4-bis(4-fluorophenyl)phosphinoselenoyl-N-[3-(dioxidanylmethyl)-5-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]benzamide

Systemtic Name: 4-bis(4-fluorophenyl)phosphinoselenoyl-N-[3-(dioxidanylmethyl)-5-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)phenyl]benzamide Openeye Name: 4-bis(4-fluorophenyl)phosphinoselenoyl-N-[3-(hydroperoxymethyl)-5-(5-thioxo-2H-tetrazol-1-yl)phenyl]benzamide CAS Name: 4-bis(4-fluorophenyl)phosphinoselenoyl-N-[3-(hydroperoxymethyl)-5-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]benzamide IUPAC Name: 4-bis(4-fluorophenyl)phosphinoselenoyl-N-[3-(hydroperoxymethyl)-5-(5-sulfanylidene-2H-tetrazol-1-yl)phenyl]benzamide Traditional Name: 4-bis(4-fluorophenyl)selenophosphoryl-N-[3-(hydroperoxymethyl)-5-(5-thioxo-2H-tetrazol-1-yl)phenyl]benzamide Formula: C27H20F2N5O3PSSe MolecularWeight: 642.474967

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC(=CC(=C2)N3C(=S)N=NN3)COO)P(=[Se])(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC(=CC(=C2)N3C(=S)N=NN3)COO)P(=[Se])(C4=CC=C(C=C4)F)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H20F2N5O3PSSe/c28-19-3-9-24(10-4-19)38(40,25-11-5-20(29)6-12-25)23-7-1-18(2-8-23)26(35)30-21-13-17(16-37-36)14-22(15-21)34-27(39)31-32-33-34/h1-15,36H,16H2,(H,30,35)(H,31,33,39)