S-(3-cyano-6-phenyl-pyridin-2-yl) 4-chloranylbenzenecarbothioate

Systemtic Name: S-(3-cyano-6-phenyl-pyridin-2-yl) 4-chloranylbenzenecarbothioate Openeye Name: S-(3-cyano-6-phenyl-2-pyridyl) 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-(3-cyano-6-phenyl-2-pyridinyl) ester IUPAC Name: S-(3-cyano-6-phenylpyridin-2-yl) 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-(3-cyano-6-phenyl-2-pyridyl) ester Formula: C19H11ClN2OS MolecularWeight: 350.82144

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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=C(C=C3)Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H11ClN2OS/c20-16-9-6-14(7-10-16)19(23)24-18-15(12-21)8-11-17(22-18)13-4-2-1-3-5-13/h1-11H