2-(1,3-benzothiazol-2-ylsulfanyl)-2-methyl-propanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-2-methyl-propanenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-2-methyl-propanenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-2-methylpropanenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-2-methylpropanenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-2-methyl-propionitrile Formula: C11H10N2S2 MolecularWeight: 234.3405

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)SC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)(C#N)SC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C11H10N2S2/c1-11(2,7-12)15-10-13-8-5-3-4-6-9(8)14-10/h3-6H,1-2H3