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

Systemtic Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxidanylidene-4-(1,3,4-thiadiazol-2-ylsulfanyl)pentanenitrile Openeye Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(1,3,4-thiadiazol-2-ylsulfanyl)pentanenitrile CAS Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(1,3,4-thiadiazol-2-ylthio)pentanenitrile IUPAC Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-oxo-4-(1,3,4-thiadiazol-2-ylsulfanyl)pentanenitrile Traditional Name: (2E)-2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-4-(1,3,4-thiadiazol-2-ylthio)valeronitrile Formula: C14H10N4OS3 MolecularWeight: 346.4504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(=C1NC2=CC=CC=C2S1)C#N)SC3=NN=CS3

Isomeric SMILES

CC(C(=O)/C(=C/1\NC2=CC=CC=C2S1)/C#N)SC3=NN=CS3

InChI

InChI=1S/C14H10N4OS3/c1-8(21-14-18-16-7-20-14)12(19)9(6-15)13-17-10-4-2-3-5-11(10)22-13/h2-5,7-8,17H,1H3/b13-9+