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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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