N-(2-phenylsulfanylethyl)pyridine-3-carboxamide

Systemtic Name: N-(2-phenylsulfanylethyl)pyridine-3-carboxamide Openeye Name: N-(2-phenylsulfanylethyl)pyridine-3-carboxamide CAS Name: N-[2-(phenylthio)ethyl]-3-pyridinecarboxamide IUPAC Name: N-(2-phenylsulfanylethyl)pyridine-3-carboxamide Traditional Name: N-[2-(phenylthio)ethyl]nicotinamide Formula: C14H14N2OS MolecularWeight: 258.33876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)C2=CN=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)C2=CN=CC=C2

InChI

InChI=1S/C14H14N2OS/c17-14(12-5-4-8-15-11-12)16-9-10-18-13-6-2-1-3-7-13/h1-8,11H,9-10H2,(H,16,17)