sodium (2E)-2-(1,3-benzothiazol-2-yl)-2-oxidanidylimino-ethanenitrile

Systemtic Name: sodium (2E)-2-(1,3-benzothiazol-2-yl)-2-oxidanidylimino-ethanenitrile Openeye Name: sodium (2E)-N-oxido-1,3-benzothiazole-2-carboximidoyl cyanide CAS Name: sodium (2E)-2-(1,3-benzothiazol-2-yl)-2-oxidoiminoacetonitrile IUPAC Name: sodium (2E)-N-oxido-1,3-benzothiazole-2-carboximidoyl cyanide Traditional Name: sodium (2E)-2-(1,3-benzothiazol-2-yl)-2-oxidoimino-acetonitrile Formula: C9H4N3NaOS MolecularWeight: 225.20233

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=N[O-])C#N.[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C(=N/[O-])/C#N.[Na+]

InChI

InChI=1S/C9H5N3OS.Na/c10-5-7(12-13)9-11-6-3-1-2-4-8(6)14-9;/h1-4,13H;/q;+1/p-1/b12-7+;