sodium 3-ethyl-2-ethylsulfanyl-5-(2-oxidanidylperoxysulfanylethyl)pyrrolo[3,2-f]benzimidazole

Systemtic Name: sodium 3-ethyl-2-ethylsulfanyl-5-(2-oxidanidylperoxysulfanylethyl)pyrrolo[3,2-f]benzimidazole Openeye Name: sodium 3-ethyl-2-ethylsulfanyl-5-(2-oxidoperoxysulfanylethyl)pyrrolo[3,2-f]benzimidazole CAS Name: sodium 2-[3-ethyl-2-(ethylthio)-5-pyrrolo[3,2-f]benzimidazolyl]ethanesulfenic acid oxidooxy ester IUPAC Name: sodium 3-ethyl-2-ethylsulfanyl-5-(2-oxidoperoxysulfanylethyl)pyrrolo[3,2-f]benzimidazole Traditional Name: sodium 3-ethyl-2-(ethylthio)-5-[2-(oxidoperoxythio)ethyl]pyrrolo[3,2-f]benzimidazole Formula: C15H18N3NaO3S2 MolecularWeight: 375.44149

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C3C=CN(C3=C2)CCSOO[O-])N=C1SCC.[Na+]

Isomeric SMILES

CCN1C2=C(C=C3C=CN(C3=C2)CCSOO[O-])N=C1SCC.[Na+]

InChI

InChI=1S/C15H19N3O3S2.Na/c1-3-18-14-10-13-11(9-12(14)16-15(18)22-4-2)5-6-17(13)7-8-23-21-20-19;/h5-6,9-10,19H,3-4,7-8H2,1-2H3;/q;+1/p-1