4-[3-(4-azanylperoxysulfanyloxyphenyl)sulfanylpropyl-(1,2,4-triazol-4-yl)amino]benzenecarbonitrile

Systemtic Name: 4-[3-(4-azanylperoxysulfanyloxyphenyl)sulfanylpropyl-(1,2,4-triazol-4-yl)amino]benzenecarbonitrile Openeye Name: 4-[3-(4-aminoperoxysulfanyloxyphenyl)sulfanylpropyl-(1,2,4-triazol-4-yl)amino]benzonitrile CAS Name: 4-[3-[[4-(aminodioxythio)oxyphenyl]thio]propyl-(1,2,4-triazol-4-yl)amino]benzonitrile IUPAC Name: 4-[3-(4-aminoperoxysulfanyloxyphenyl)sulfanylpropyl-(1,2,4-triazol-4-yl)amino]benzonitrile Traditional Name: 4-[3-[[4-(aminoperoxythio)oxyphenyl]thio]propyl-(1,2,4-triazol-4-yl)amino]benzonitrile Formula: C18H18N6O3S2 MolecularWeight: 430.50392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)N(CCCSC2=CC=C(C=C2)OSOON)N3C=NN=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)N(CCCSC2=CC=C(C=C2)OSOON)N3C=NN=C3

InChI

InChI=1S/C18H18N6O3S2/c19-12-15-2-4-16(5-3-15)24(23-13-21-22-14-23)10-1-11-28-18-8-6-17(7-9-18)25-29-27-26-20/h2-9,13-14H,1,10-11,20H2