2-[[4-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid

Systemtic Name: 2-[[4-[(2-chloranyl-5-methylsulfanyl-phenyl)carbonylamino]phenyl]sulfonylamino]ethanoic acid Openeye Name: 2-[[4-[(2-chloro-5-methylsulfanyl-benzoyl)amino]phenyl]sulfonylamino]acetic acid CAS Name: 2-[[4-[[[2-chloro-5-(methylthio)phenyl]-oxomethyl]amino]phenyl]sulfonylamino]acetic acid IUPAC Name: 2-[[4-[(2-chloro-5-methylsulfanylbenzoyl)amino]phenyl]sulfonylamino]acetic acid Traditional Name: 2-[[4-[[2-chloro-5-(methylthio)benzoyl]amino]phenyl]sulfonylamino]acetic acid Formula: C16H15ClN2O5S2 MolecularWeight: 414.8837

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC(=C(C=C1)Cl)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

Isomeric SMILES

CSC1=CC(=C(C=C1)Cl)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NCC(=O)O

InChI

InChI=1S/C16H15ClN2O5S2/c1-25-11-4-7-14(17)13(8-11)16(22)19-10-2-5-12(6-3-10)26(23,24)18-9-15(20)21/h2-8,18H,9H2,1H3,(H,19,22)(H,20,21)