(5-phenylimino-1,2-dithiol-3-yl)sulfanyl ethanoate hydrobromide

Systemtic Name: (5-phenylimino-1,2-dithiol-3-yl)sulfanyl ethanoate hydrobromide Openeye Name: (5-phenyliminodithiol-3-yl)sulfanyl acetate hydrobromide CAS Name: acetic acid [(5-phenylimino-3-dithiolyl)thio] ester hydrobromide IUPAC Name: (5-phenyliminodithiol-3-yl)sulfanyl acetate hydrobromide Traditional Name: acetic acid [(5-phenyliminodithiol-3-yl)thio] ester hydrobromide Formula: C11H10BrNO2S3 MolecularWeight: 364.3016

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OSC1=CC(=NC2=CC=CC=C2)SS1.Br

Isomeric SMILES

CC(=O)OSC1=CC(=NC2=CC=CC=C2)SS1.Br

InChI

InChI=1S/C11H9NO2S3.BrH/c1-8(13)14-15-11-7-10(16-17-11)12-9-5-3-2-4-6-9;/h2-7H,1H3;1H