2-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanenitrile

Systemtic Name: 2-(5-chloranyl-2-oxidanylidene-1,3-benzothiazol-3-yl)ethanenitrile Openeye Name: 2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetonitrile CAS Name: 2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetonitrile IUPAC Name: 2-(5-chloro-2-oxo-1,3-benzothiazol-3-yl)acetonitrile Traditional Name: 2-(5-chloro-2-keto-1,3-benzothiazol-3-yl)acetonitrile Formula: C9H5ClN2OS MolecularWeight: 224.6668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N(C(=O)S2)CC#N

Isomeric SMILES

C1=CC2=C(C=C1Cl)N(C(=O)S2)CC#N

InChI

InChI=1S/C9H5ClN2OS/c10-6-1-2-8-7(5-6)12(4-3-11)9(13)14-8/h1-2,5H,4H2