methyl 4-[2-[2-[4-(thiophen-2-ylsulfonylamino)phenyl]ethanoylamino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[2-[4-(thiophen-2-ylsulfonylamino)phenyl]ethanoylamino]ethyl]benzoate Openeye Name: methyl 4-[2-[[2-[4-(2-thienylsulfonylamino)phenyl]acetyl]amino]ethyl]benzoate CAS Name: 4-[2-[[1-oxo-2-[4-(thiophen-2-ylsulfonylamino)phenyl]ethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-[4-(thiophen-2-ylsulfonylamino)phenyl]acetyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[2-[4-(2-thienylsulfonylamino)phenyl]acetyl]amino]ethyl]benzoic acid methyl ester Formula: C22H22N2O5S2 MolecularWeight: 458.55048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNC(=O)CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNC(=O)CC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H22N2O5S2/c1-29-22(26)18-8-4-16(5-9-18)12-13-23-20(25)15-17-6-10-19(11-7-17)24-31(27,28)21-3-2-14-30-21/h2-11,14,24H,12-13,15H2,1H3,(H,23,25)