S-pyridin-2-yl 3-(3-cyanophenyl)propanethioate

Systemtic Name: S-pyridin-2-yl 3-(3-cyanophenyl)propanethioate Openeye Name: S-(2-pyridyl) 3-(3-cyanophenyl)propanethioate CAS Name: 3-(3-cyanophenyl)propanethioic acid S-(2-pyridinyl) ester IUPAC Name: S-pyridin-2-yl 3-(3-cyanophenyl)propanethioate Traditional Name: 3-(3-cyanophenyl)propanethioic acid S-(2-pyridyl) ester Formula: C15H12N2OS MolecularWeight: 268.33358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)SC(=O)CCC2=CC=CC(=C2)C#N

Isomeric SMILES

C1=CC=NC(=C1)SC(=O)CCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H12N2OS/c16-11-13-5-3-4-12(10-13)7-8-15(18)19-14-6-1-2-9-17-14/h1-6,9-10H,7-8H2