(2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-(1,3,4-thiadiazol-2-ylsulfanyl)butanenitrile

Systemtic Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-(1,3,4-thiadiazol-2-ylsulfanyl)butanenitrile Openeye Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(1,3,4-thiadiazol-2-ylsulfanyl)butanenitrile CAS Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(1,3,4-thiadiazol-2-ylthio)butanenitrile IUPAC Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(1,3,4-thiadiazol-2-ylsulfanyl)butanenitrile Traditional Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-4-(1,3,4-thiadiazol-2-ylthio)butyronitrile Formula: C13H8N4OS3 MolecularWeight: 332.42382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CSC3=NN=CS3)S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C(/C#N)\C(=O)CSC3=NN=CS3)/S2

InChI

InChI=1S/C13H8N4OS3/c14-5-8(10(18)6-19-13-17-15-7-20-13)12-16-9-3-1-2-4-11(9)21-12/h1-4,7,16H,6H2/b12-8+