N-(1-benzofuran-5-yl)-2-methylsulfanyl-N-methylsulfonyl-propanamide

Systemtic Name: N-(1-benzofuran-5-yl)-2-methylsulfanyl-N-methylsulfonyl-propanamide Openeye Name: N-(benzofuran-5-yl)-2-methylsulfanyl-N-methylsulfonyl-propanamide CAS Name: N-(5-benzofuranyl)-N-methylsulfonyl-2-(methylthio)propanamide IUPAC Name: N-(1-benzofuran-5-yl)-2-methylsulfanyl-N-methylsulfonylpropanamide Traditional Name: N-(benzofuran-5-yl)-N-mesyl-2-(methylthio)propionamide Formula: C13H15NO4S2 MolecularWeight: 313.3925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C1=CC2=C(C=C1)OC=C2)S(=O)(=O)C)SC

Isomeric SMILES

CC(C(=O)N(C1=CC2=C(C=C1)OC=C2)S(=O)(=O)C)SC

InChI

InChI=1S/C13H15NO4S2/c1-9(19-2)13(15)14(20(3,16)17)11-4-5-12-10(8-11)6-7-18-12/h4-9H,1-3H3