1,3-benzothiazol-2-yl (1E)-1-cyano-N-oxidanidyl-methanimidothioate

Systemtic Name: 1,3-benzothiazol-2-yl (1E)-1-cyano-N-oxidanidyl-methanimidothioate Openeye Name: 1,3-benzothiazol-2-yl (1E)-1-cyano-N-oxido-methanimidothioate CAS Name: (1E)-1-cyano-N-oxidomethanimidothioic acid 1,3-benzothiazol-2-yl ester IUPAC Name: 1,3-benzothiazol-2-yl (1E)-1-cyano-N-oxidomethanimidothioate Traditional Name: (1E)-1-cyano-N-oxido-thioformimidic acid 1,3-benzothiazol-2-yl ester Formula: C9H4N3OS2- MolecularWeight: 234.27756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC(=N[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)S/C(=N/[O-])/C#N

InChI

InChI=1S/C9H5N3OS2/c10-5-8(12-13)15-9-11-6-3-1-2-4-7(6)14-9/h1-4,13H/p-1/b12-8+