2-(6-chloranyl-1,3-benzothiazol-2-yl)-2-phenyl-ethanenitrile

Systemtic Name: 2-(6-chloranyl-1,3-benzothiazol-2-yl)-2-phenyl-ethanenitrile Openeye Name: 2-(6-chloro-1,3-benzothiazol-2-yl)-2-phenyl-acetonitrile CAS Name: 2-(6-chloro-1,3-benzothiazol-2-yl)-2-phenylacetonitrile IUPAC Name: 2-(6-chloro-1,3-benzothiazol-2-yl)-2-phenylacetonitrile Traditional Name: 2-(6-chloro-1,3-benzothiazol-2-yl)-2-phenyl-acetonitrile Formula: C15H9ClN2S MolecularWeight: 284.76336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C2=NC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)C2=NC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C15H9ClN2S/c16-11-6-7-13-14(8-11)19-15(18-13)12(9-17)10-4-2-1-3-5-10/h1-8,12H