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

Systemtic Name: S-(3-cyano-6-phenyl-pyridin-2-yl) cyclohexanecarbothioate Openeye Name: S-(3-cyano-6-phenyl-2-pyridyl) cyclohexanecarbothioate CAS Name: cyclohexanecarbothioic acid S-(3-cyano-6-phenyl-2-pyridinyl) ester IUPAC Name: S-(3-cyano-6-phenylpyridin-2-yl) cyclohexanecarbothioate Traditional Name: cyclohexanecarbothioic acid S-(3-cyano-6-phenyl-2-pyridyl) ester Formula: C19H18N2OS MolecularWeight: 322.42402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)SC2=C(C=CC(=N2)C3=CC=CC=C3)C#N

Isomeric SMILES

C1CCC(CC1)C(=O)SC2=C(C=CC(=N2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C19H18N2OS/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/h1,3-4,7-8,11-12,15H,2,5-6,9-10H2