ethyl 2-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[3-methyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[3-methyl-4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[4-(2-ketopyrrolidino)-3-methyl-phenyl]sulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C22H26N2O5S2 MolecularWeight: 462.58224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)C3=CC(=C(C=C3)N4CCCC4=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)C3=CC(=C(C=C3)N4CCCC4=O)C

InChI

InChI=1S/C22H26N2O5S2/c1-3-29-22(26)20-16-7-4-5-8-18(16)30-21(20)23-31(27,28)15-10-11-17(14(2)13-15)24-12-6-9-19(24)25/h10-11,13,23H,3-9,12H2,1-2H3