3-[(3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)sulfamoyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[(3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)sulfamoyl]thiophene-2-carboxylic acid Openeye Name: 3-[[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]sulfamoyl]thiophene-2-carboxylic acid CAS Name: 3-[[3-[4-morpholinyl(oxo)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]sulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]sulfamoyl]thiophene-2-carboxylic acid Traditional Name: 3-[[3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]sulfamoyl]-2-thenoic acid Formula: C18H20N2O6S3 MolecularWeight: 456.5562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NS(=O)(=O)C3=C(SC=C3)C(=O)O)C(=O)N4CCOCC4

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NS(=O)(=O)C3=C(SC=C3)C(=O)O)C(=O)N4CCOCC4

InChI

InChI=1S/C18H20N2O6S3/c21-17(20-6-8-26-9-7-20)14-11-3-1-2-4-12(11)28-16(14)19-29(24,25)13-5-10-27-15(13)18(22)23/h5,10,19H,1-4,6-9H2,(H,22,23)