1-[3-(dioxidanylmethyl)-5-(diphenylphosphinoselenoylamino)phenyl]-2H-1,2,3,4-tetrazole-5-thione

Systemtic Name: 1-[3-(dioxidanylmethyl)-5-(diphenylphosphinoselenoylamino)phenyl]-2H-1,2,3,4-tetrazole-5-thione Openeye Name: 1-[3-(diphenylphosphinoselenoylamino)-5-(hydroperoxymethyl)phenyl]-2H-tetrazole-5-thione CAS Name: 1-[3-(diphenylphosphinoselenoylamino)-5-(hydroperoxymethyl)phenyl]-2H-tetrazole-5-thione IUPAC Name: 1-[3-(diphenylphosphinoselenoylamino)-5-(hydroperoxymethyl)phenyl]-2H-tetrazole-5-thione Traditional Name: 1-[3-(diphenylselenophosphorylamino)-5-(hydroperoxymethyl)phenyl]-2H-tetrazole-5-thione Formula: C20H18N5O2PSSe MolecularWeight: 502.387981

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=[Se])(C2=CC=CC=C2)NC3=CC(=CC(=C3)N4C(=S)N=NN4)COO

Isomeric SMILES

C1=CC=C(C=C1)P(=[Se])(C2=CC=CC=C2)NC3=CC(=CC(=C3)N4C(=S)N=NN4)COO

InChI

InChI=1S/C20H18N5O2PSSe/c26-27-14-15-11-16(13-17(12-15)25-20(29)21-23-24-25)22-28(30,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-13,26H,14H2,(H,22,30)(H,21,24,29)