methyl (3S)-3-(4-methylphenyl)-3-[[3-(thiophen-2-ylmethylsulfamoyl)phenyl]carbonylamino]propanoate

Systemtic Name: methyl (3S)-3-(4-methylphenyl)-3-[[3-(thiophen-2-ylmethylsulfamoyl)phenyl]carbonylamino]propanoate Openeye Name: methyl (3S)-3-(p-tolyl)-3-[[3-(2-thienylmethylsulfamoyl)benzoyl]amino]propanoate CAS Name: (3S)-3-(4-methylphenyl)-3-[[oxo-[3-(thiophen-2-ylmethylsulfamoyl)phenyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (3S)-3-(4-methylphenyl)-3-[[3-(thiophen-2-ylmethylsulfamoyl)benzoyl]amino]propanoate Traditional Name: (3S)-3-(p-tolyl)-3-[[3-(2-thenylsulfamoyl)benzoyl]amino]propionic acid methyl ester Formula: C23H24N2O5S2 MolecularWeight: 472.57706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CC(=O)OC)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CC(=O)OC)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3=CC=CS3

InChI

InChI=1S/C23H24N2O5S2/c1-16-8-10-17(11-9-16)21(14-22(26)30-2)25-23(27)18-5-3-7-20(13-18)32(28,29)24-15-19-6-4-12-31-19/h3-13,21,24H,14-15H2,1-2H3,(H,25,27)/t21-/m0/s1