[2-(azepan-1-yl)-2-oxidanylidene-ethyl] 5-sulfamoylthiophene-3-carboxylate

Systemtic Name: [2-(azepan-1-yl)-2-oxidanylidene-ethyl] 5-sulfamoylthiophene-3-carboxylate Openeye Name: [2-(azepan-1-yl)-2-oxo-ethyl] 5-sulfamoylthiophene-3-carboxylate CAS Name: 5-sulfamoyl-3-thiophenecarboxylic acid [2-(1-azepanyl)-2-oxoethyl] ester IUPAC Name: [2-(azepan-1-yl)-2-oxoethyl] 5-sulfamoylthiophene-3-carboxylate Traditional Name: 5-sulfamoylthiophene-3-carboxylic acid [2-(azepan-1-yl)-2-keto-ethyl] ester Formula: C13H18N2O5S2 MolecularWeight: 346.42242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)COC(=O)C2=CSC(=C2)S(=O)(=O)N

Isomeric SMILES

C1CCCN(CC1)C(=O)COC(=O)C2=CSC(=C2)S(=O)(=O)N

InChI

InChI=1S/C13H18N2O5S2/c14-22(18,19)12-7-10(9-21-12)13(17)20-8-11(16)15-5-3-1-2-4-6-15/h7,9H,1-6,8H2,(H2,14,18,19)