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

Systemtic Name: methyl 2-[2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanylpropanoylamino]benzoate Openeye Name: methyl 2-[2-[4-(2-thienylsulfonylamino)phenyl]sulfanylpropanoylamino]benzoate CAS Name: 2-[[1-oxo-2-[[4-(thiophen-2-ylsulfonylamino)phenyl]thio]propyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[2-[4-(thiophen-2-ylsulfonylamino)phenyl]sulfanylpropanoylamino]benzoate Traditional Name: 2-[2-[[4-(2-thienylsulfonylamino)phenyl]thio]propanoylamino]benzoic acid methyl ester Formula: C21H20N2O5S3 MolecularWeight: 476.5889

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1C(=O)OC)SC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H20N2O5S3/c1-14(20(24)22-18-7-4-3-6-17(18)21(25)28-2)30-16-11-9-15(10-12-16)23-31(26,27)19-8-5-13-29-19/h3-14,23H,1-2H3,(H,22,24)