4-(2-pyrimidin-2-ylsulfanylethoxy)benzenesulfonamide

Systemtic Name: 4-(2-pyrimidin-2-ylsulfanylethoxy)benzenesulfonamide Openeye Name: 4-(2-pyrimidin-2-ylsulfanylethoxy)benzenesulfonamide CAS Name: 4-[2-(2-pyrimidinylthio)ethoxy]benzenesulfonamide IUPAC Name: 4-(2-pyrimidin-2-ylsulfanylethoxy)benzenesulfonamide Traditional Name: 4-[2-(2-pyrimidylthio)ethoxy]benzenesulfonamide Formula: C12H13N3O3S2 MolecularWeight: 311.37992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCCOC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

C1=CN=C(N=C1)SCCOC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C12H13N3O3S2/c13-20(16,17)11-4-2-10(3-5-11)18-8-9-19-12-14-6-1-7-15-12/h1-7H,8-9H2,(H2,13,16,17)