(E)-3-(1H-benzimidazol-2-ylsulfanyl)-1-diazonio-but-1-en-2-olate

Systemtic Name: (E)-3-(1H-benzimidazol-2-ylsulfanyl)-1-diazonio-but-1-en-2-olate Openeye Name: (E)-3-(1H-benzimidazol-2-ylsulfanyl)-1-diazonio-but-1-en-2-olate CAS Name: (E)-3-(1H-benzimidazol-2-ylthio)-1-diazonio-1-buten-2-olate IUPAC Name: (E)-3-(1H-benzimidazol-2-ylsulfanyl)-1-diazoniobut-1-en-2-olate Traditional Name: (E)-3-(1H-benzimidazol-2-ylthio)-1-diazonio-but-1-en-2-olate Formula: C11H10N4OS MolecularWeight: 246.2883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C[N+]#N)[O-])SC1=NC2=CC=CC=C2N1

Isomeric SMILES

CC(/C(=C\[N+]#N)/[O-])SC1=NC2=CC=CC=C2N1

InChI

InChI=1S/C11H10N4OS/c1-7(10(16)6-13-12)17-11-14-8-4-2-3-5-9(8)15-11/h2-7H,1H3,(H-,14,15,16)/b10-6+