N4-[5-chloranyl-4-[2-(4-methylsulfanylphenyl)sulfonylpropanoylamino]-2-oxidanyl-phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N4-[5-chloranyl-4-[2-(4-methylsulfanylphenyl)sulfonylpropanoylamino]-2-oxidanyl-phenyl]benzene-1,4-dicarboxamide Openeye Name: N4-[5-chloro-2-hydroxy-4-[2-(4-methylsulfanylphenyl)sulfonylpropanoylamino]phenyl]terephthalamide CAS Name: N4-[5-chloro-2-hydroxy-4-[[2-[4-(methylthio)phenyl]sulfonyl-1-oxopropyl]amino]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 4-N-[5-chloro-2-hydroxy-4-[2-(4-methylsulfanylphenyl)sulfonylpropanoylamino]phenyl]benzene-1,4-dicarboxamide Traditional Name: N'-[5-chloro-2-hydroxy-4-[2-[4-(methylthio)phenyl]sulfonylpropanoylamino]phenyl]terephthalamide Formula: C24H22ClN3O6S2 MolecularWeight: 548.03098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C2=CC=C(C=C2)C(=O)N)O)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C2=CC=C(C=C2)C(=O)N)O)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C24H22ClN3O6S2/c1-13(36(33,34)17-9-7-16(35-2)8-10-17)23(31)27-19-12-21(29)20(11-18(19)25)28-24(32)15-5-3-14(4-6-15)22(26)30/h3-13,29H,1-2H3,(H2,26,30)(H,27,31)(H,28,32)