4-(2,1,3-benzothiadiazol-4-yl)-3-methyl-4-oxidanylidene-butanenitrile

Systemtic Name: 4-(2,1,3-benzothiadiazol-4-yl)-3-methyl-4-oxidanylidene-butanenitrile Openeye Name: 4-(2,1,3-benzothiadiazol-4-yl)-3-methyl-4-oxo-butanenitrile CAS Name: 4-(2,1,3-benzothiadiazol-4-yl)-3-methyl-4-oxobutanenitrile IUPAC Name: 4-(2,1,3-benzothiadiazol-4-yl)-3-methyl-4-oxobutanenitrile Traditional Name: 4-keto-3-methyl-4-piazthiol-4-yl-butyronitrile Formula: C11H9N3OS MolecularWeight: 231.27366

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)C(=O)C1=CC=CC2=NSN=C21

Isomeric SMILES

CC(CC#N)C(=O)C1=CC=CC2=NSN=C21

InChI

InChI=1S/C11H9N3OS/c1-7(5-6-12)11(15)8-3-2-4-9-10(8)14-16-13-9/h2-4,7H,5H2,1H3