N'-[2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]ethanedithioamide

Systemtic Name: N'-[2-(1,3-benzothiazol-2-yl)-2-cyano-ethenyl]ethanedithioamide Openeye Name: N'-[2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]ethanedithioamide CAS Name: N'-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]ethanedithioamide IUPAC Name: N'-[2-(1,3-benzothiazol-2-yl)-2-cyanoethenyl]ethanedithioamide Traditional Name: N'-[2-(1,3-benzothiazol-2-yl)-2-cyano-vinyl]ethanedithioamide Formula: C12H8N4S3 MolecularWeight: 304.41372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=CNC(=S)C(=S)N)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(=CNC(=S)C(=S)N)C#N

InChI

InChI=1S/C12H8N4S3/c13-5-7(6-15-11(18)10(14)17)12-16-8-3-1-2-4-9(8)19-12/h1-4,6H,(H2,14,17)(H,15,18)