2-(4-cyanophenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: 2-(4-cyanophenyl)sulfanylpyridine-3-carboxylate Openeye Name: 2-(4-cyanophenyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(4-cyanophenyl)thio]-3-pyridinecarboxylate IUPAC Name: 2-(4-cyanophenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(4-cyanophenyl)thio]nicotinate Formula: C13H7N2O2S- MolecularWeight: 255.27188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SC2=CC=C(C=C2)C#N)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SC2=CC=C(C=C2)C#N)C(=O)[O-]

InChI

InChI=1S/C13H8N2O2S/c14-8-9-3-5-10(6-4-9)18-12-11(13(16)17)2-1-7-15-12/h1-7H,(H,16,17)/p-1