(2R)-2-(1,3-benzothiazol-2-yl)-2-(3-nitropyridin-2-yl)ethanenitrile

Systemtic Name: (2R)-2-(1,3-benzothiazol-2-yl)-2-(3-nitropyridin-2-yl)ethanenitrile Openeye Name: (2R)-2-(1,3-benzothiazol-2-yl)-2-(3-nitro-2-pyridyl)acetonitrile CAS Name: (2R)-2-(1,3-benzothiazol-2-yl)-2-(3-nitro-2-pyridinyl)acetonitrile IUPAC Name: (2R)-2-(1,3-benzothiazol-2-yl)-2-(3-nitropyridin-2-yl)acetonitrile Traditional Name: (2R)-2-(1,3-benzothiazol-2-yl)-2-(3-nitro-2-pyridyl)acetonitrile Formula: C14H8N4O2S MolecularWeight: 296.30392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(C#N)C3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)[C@@H](C#N)C3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C14H8N4O2S/c15-8-9(13-11(18(19)20)5-3-7-16-13)14-17-10-4-1-2-6-12(10)21-14/h1-7,9H/t9-/m0/s1