ethyl 5-[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]thiophene-2-carboxylate

Systemtic Name: ethyl 5-[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 5-[(3-indolin-1-ylsulfonylbenzoyl)amino]thiophene-2-carboxylate CAS Name: 5-[[[3-(2,3-dihydroindol-1-ylsulfonyl)phenyl]-oxomethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[3-(2,3-dihydroindol-1-ylsulfonyl)benzoyl]amino]thiophene-2-carboxylate Traditional Name: 5-[(3-indolin-1-ylsulfonylbenzoyl)amino]thiophene-2-carboxylic acid ethyl ester Formula: C22H20N2O5S2 MolecularWeight: 456.5346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=CC=C(S1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C22H20N2O5S2/c1-2-29-22(26)19-10-11-20(30-19)23-21(25)16-7-5-8-17(14-16)31(27,28)24-13-12-15-6-3-4-9-18(15)24/h3-11,14H,2,12-13H2,1H3,(H,23,25)