2-[[4-(4-methylsulfanylphenyl)phenyl]sulfonylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[4-(4-methylsulfanylphenyl)phenyl]sulfonylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[4-(4-methylsulfanylphenyl)phenyl]sulfonylamino]-3-phenyl-propanoic acid CAS Name: 2-[[4-[4-(methylthio)phenyl]phenyl]sulfonylamino]-3-phenylpropanoic acid IUPAC Name: 2-[[4-(4-methylsulfanylphenyl)phenyl]sulfonylamino]-3-phenylpropanoic acid Traditional Name: 2-[[4-[4-(methylthio)phenyl]phenyl]sulfonylamino]-3-phenyl-propionic acid Formula: C22H21NO4S2 MolecularWeight: 427.53644

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC=C(C=C2)S(=O)(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C22H21NO4S2/c1-28-19-11-7-17(8-12-19)18-9-13-20(14-10-18)29(26,27)23-21(22(24)25)15-16-5-3-2-4-6-16/h2-14,21,23H,15H2,1H3,(H,24,25)