4-[2-(1-methylimidazol-2-yl)sulfanylethoxy]benzenesulfonamide

Systemtic Name: 4-[2-(1-methylimidazol-2-yl)sulfanylethoxy]benzenesulfonamide Openeye Name: 4-[2-(1-methylimidazol-2-yl)sulfanylethoxy]benzenesulfonamide CAS Name: 4-[2-[(1-methyl-2-imidazolyl)thio]ethoxy]benzenesulfonamide IUPAC Name: 4-[2-(1-methylimidazol-2-yl)sulfanylethoxy]benzenesulfonamide Traditional Name: 4-[2-[(1-methylimidazol-2-yl)thio]ethoxy]benzenesulfonamide Formula: C12H15N3O3S2 MolecularWeight: 313.3958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CN1C=CN=C1SCCOC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C12H15N3O3S2/c1-15-7-6-14-12(15)19-9-8-18-10-2-4-11(5-3-10)20(13,16)17/h2-7H,8-9H2,1H3,(H2,13,16,17)