2-[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]ethanenitrile

Systemtic Name: 2-[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]ethanenitrile Openeye Name: 2-(4,5-dichloro-1,3-benzothiazol-2-yl)acetonitrile CAS Name: 2-(4,5-dichloro-1,3-benzothiazol-2-yl)acetonitrile IUPAC Name: 2-(4,5-dichloro-1,3-benzothiazol-2-yl)acetonitrile Traditional Name: 2-(4,5-dichloro-1,3-benzothiazol-2-yl)acetonitrile Formula: C9H4Cl2N2S MolecularWeight: 243.11246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C2=C1SC(=N2)CC#N)Cl)Cl

Isomeric SMILES

C1=CC(=C(C2=C1SC(=N2)CC#N)Cl)Cl

InChI

InChI=1S/C9H4Cl2N2S/c10-5-1-2-6-9(8(5)11)13-7(14-6)3-4-12/h1-2H,3H2