butyl 4-[[3-(phenylsulfonylamino)thiophen-2-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[3-(phenylsulfonylamino)thiophen-2-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[3-(benzenesulfonamido)thiophene-2-carbonyl]amino]benzoate CAS Name: 4-[[[3-(benzenesulfonamido)-2-thiophenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[3-(benzenesulfonamido)thiophene-2-carbonyl]amino]benzoate Traditional Name: 4-[[3-(benzenesulfonamido)thiophene-2-carbonyl]amino]benzoic acid butyl ester Formula: C22H22N2O5S2 MolecularWeight: 458.55048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CS2)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CS2)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O5S2/c1-2-3-14-29-22(26)16-9-11-17(12-10-16)23-21(25)20-19(13-15-30-20)24-31(27,28)18-7-5-4-6-8-18/h4-13,15,24H,2-3,14H2,1H3,(H,23,25)