4-[2-(5-azanylpyridin-2-yl)sulfanylethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(5-azanylpyridin-2-yl)sulfanylethoxy]benzenecarbonitrile Openeye Name: 4-[2-[(5-amino-2-pyridyl)sulfanyl]ethoxy]benzonitrile CAS Name: 4-[2-[(5-amino-2-pyridinyl)thio]ethoxy]benzonitrile IUPAC Name: 4-[2-(5-aminopyridin-2-yl)sulfanylethoxy]benzonitrile Traditional Name: 4-[2-[(5-amino-2-pyridyl)thio]ethoxy]benzonitrile Formula: C14H13N3OS MolecularWeight: 271.33752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)OCCSC2=NC=C(C=C2)N

Isomeric SMILES

C1=CC(=CC=C1C#N)OCCSC2=NC=C(C=C2)N

InChI

InChI=1S/C14H13N3OS/c15-9-11-1-4-13(5-2-11)18-7-8-19-14-6-3-12(16)10-17-14/h1-6,10H,7-8,16H2