2-[4-[[4-(methylsulfamoyl)phenyl]carbamothioylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[[4-(methylsulfamoyl)phenyl]carbamothioylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[[4-(methylsulfamoyl)phenyl]carbamothioylamino]phenyl]acetic acid CAS Name: 2-[4-[[[4-(methylsulfamoyl)anilino]-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[[4-(methylsulfamoyl)phenyl]carbamothioylamino]phenyl]acetic acid Traditional Name: 2-[4-[[4-(methylsulfamoyl)phenyl]thiocarbamoylamino]phenyl]acetic acid Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C16H17N3O4S2/c1-17-25(22,23)14-8-6-13(7-9-14)19-16(24)18-12-4-2-11(3-5-12)10-15(20)21/h2-9,17H,10H2,1H3,(H,20,21)(H2,18,19,24)