3-cyano-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide

Systemtic Name: 3-cyano-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Openeye Name: 3-cyano-N-[4-(3-pyridylmethylsulfanyl)phenyl]benzamide CAS Name: 3-cyano-N-[4-(3-pyridinylmethylthio)phenyl]benzamide IUPAC Name: 3-cyano-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]benzamide Traditional Name: 3-cyano-N-[4-(3-pyridylmethylthio)phenyl]benzamide Formula: C20H15N3OS MolecularWeight: 345.4176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)C#N

InChI

InChI=1S/C20H15N3OS/c21-12-15-3-1-5-17(11-15)20(24)23-18-6-8-19(9-7-18)25-14-16-4-2-10-22-13-16/h1-11,13H,14H2,(H,23,24)