3-[(3-azanylpyridin-4-yl)sulfanylmethyl]-4-fluoranyl-benzamide

Systemtic Name: 3-[(3-azanylpyridin-4-yl)sulfanylmethyl]-4-fluoranyl-benzamide Openeye Name: 3-[(3-amino-4-pyridyl)sulfanylmethyl]-4-fluoro-benzamide CAS Name: 3-[[(3-amino-4-pyridinyl)thio]methyl]-4-fluorobenzamide IUPAC Name: 3-[(3-aminopyridin-4-yl)sulfanylmethyl]-4-fluorobenzamide Traditional Name: 3-[[(3-amino-4-pyridyl)thio]methyl]-4-fluoro-benzamide Formula: C13H12FN3OS MolecularWeight: 277.317283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)CSC2=C(C=NC=C2)N)F

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)CSC2=C(C=NC=C2)N)F

InChI

InChI=1S/C13H12FN3OS/c14-10-2-1-8(13(16)18)5-9(10)7-19-12-3-4-17-6-11(12)15/h1-6H,7,15H2,(H2,16,18)