2-(4-chloranyl-1,3-benzothiazol-2-yl)ethanenitrile

Systemtic Name: 2-(4-chloranyl-1,3-benzothiazol-2-yl)ethanenitrile Openeye Name: 2-(4-chloro-1,3-benzothiazol-2-yl)acetonitrile CAS Name: 2-(4-chloro-1,3-benzothiazol-2-yl)acetonitrile IUPAC Name: 2-(4-chloro-1,3-benzothiazol-2-yl)acetonitrile Traditional Name: 2-(4-chloro-1,3-benzothiazol-2-yl)acetonitrile Formula: C9H5ClN2S MolecularWeight: 208.6674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)N=C(S2)CC#N

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)N=C(S2)CC#N

InChI

InChI=1S/C9H5ClN2S/c10-6-2-1-3-7-9(6)12-8(13-7)4-5-11/h1-3H,4H2