sodium 2-sulfanylbenzene-1,3,5-tricarbonitrile

Systemtic Name: sodium 2-sulfanylbenzene-1,3,5-tricarbonitrile Openeye Name: sodium 2-sulfanylbenzene-1,3,5-tricarbonitrile CAS Name: sodium 2-mercaptobenzene-1,3,5-tricarbonitrile IUPAC Name: sodium 2-sulfanylbenzene-1,3,5-tricarbonitrile Traditional Name: sodium 2-mercaptobenzene-1,3,5-tricarbonitrile Formula: C9H3N3NaS+ MolecularWeight: 208.19499

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1C#N)S)C#N)C#N.[Na+]

Isomeric SMILES

C1=C(C=C(C(=C1C#N)S)C#N)C#N.[Na+]

InChI

InChI=1S/C9H3N3S.Na/c10-3-6-1-7(4-11)9(13)8(2-6)5-12;/h1-2,13H;/q;+1