4-[2-(3-azanylpyridin-4-yl)sulfanylethoxy]benzenesulfonamide

Systemtic Name: 4-[2-(3-azanylpyridin-4-yl)sulfanylethoxy]benzenesulfonamide Openeye Name: 4-[2-[(3-amino-4-pyridyl)sulfanyl]ethoxy]benzenesulfonamide CAS Name: 4-[2-[(3-amino-4-pyridinyl)thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-(3-aminopyridin-4-yl)sulfanylethoxy]benzenesulfonamide Traditional Name: 4-[2-[(3-amino-4-pyridyl)thio]ethoxy]benzenesulfonamide Formula: C13H15N3O3S2 MolecularWeight: 325.4065

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OCCSC2=C(C=NC=C2)N)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1OCCSC2=C(C=NC=C2)N)S(=O)(=O)N

InChI

InChI=1S/C13H15N3O3S2/c14-12-9-16-6-5-13(12)20-8-7-19-10-1-3-11(4-2-10)21(15,17)18/h1-6,9H,7-8,14H2,(H2,15,17,18)