2-(1,3-benzothiazol-2-yl)-2-(6-chloranylpyridin-2-yl)ethanenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-(6-chloranylpyridin-2-yl)ethanenitrile Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-(6-chloro-2-pyridyl)acetonitrile CAS Name: 2-(1,3-benzothiazol-2-yl)-2-(6-chloro-2-pyridinyl)acetonitrile IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-(6-chloropyridin-2-yl)acetonitrile Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-(6-chloro-2-pyridyl)acetonitrile Formula: C14H8ClN3S MolecularWeight: 285.75142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(C#N)C3=NC(=CC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(C#N)C3=NC(=CC=C3)Cl

InChI

InChI=1S/C14H8ClN3S/c15-13-7-3-5-10(17-13)9(8-16)14-18-11-4-1-2-6-12(11)19-14/h1-7,9H