S-(3-cyano-6-phenyl-pyridin-2-yl) benzenecarbothioate

Systemtic Name: S-(3-cyano-6-phenyl-pyridin-2-yl) benzenecarbothioate Openeye Name: S-(3-cyano-6-phenyl-2-pyridyl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(3-cyano-6-phenyl-2-pyridinyl) ester IUPAC Name: S-(3-cyano-6-phenylpyridin-2-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(3-cyano-6-phenyl-2-pyridyl) ester Formula: C19H12N2OS MolecularWeight: 316.37638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=C(C=C2)C#N)SC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H12N2OS/c20-13-16-11-12-17(14-7-3-1-4-8-14)21-18(16)23-19(22)15-9-5-2-6-10-15/h1-12H