N1-[5-chloranyl-4-[2-(4-methylsulfanylphenyl)sulfonylpropanoylamino]-2-oxidanyl-phenyl]-N4,N4-dimethyl-benzene-1,4-dicarboxamide

Systemtic Name: N1-[5-chloranyl-4-[2-(4-methylsulfanylphenyl)sulfonylpropanoylamino]-2-oxidanyl-phenyl]-N4,N4-dimethyl-benzene-1,4-dicarboxamide Openeye Name: N1-[5-chloro-2-hydroxy-4-[2-(4-methylsulfanylphenyl)sulfonylpropanoylamino]phenyl]-N4,N4-dimethyl-terephthalamide CAS Name: N1-[5-chloro-2-hydroxy-4-[[2-[4-(methylthio)phenyl]sulfonyl-1-oxopropyl]amino]phenyl]-N4,N4-dimethylbenzene-1,4-dicarboxamide IUPAC Name: 1-N-[5-chloro-2-hydroxy-4-[2-(4-methylsulfanylphenyl)sulfonylpropanoylamino]phenyl]-4-N,4-N-dimethylbenzene-1,4-dicarboxamide Traditional Name: N-[5-chloro-2-hydroxy-4-[2-[4-(methylthio)phenyl]sulfonylpropanoylamino]phenyl]-N',N'-dimethyl-terephthalamide Formula: C26H26ClN3O6S2 MolecularWeight: 576.08414

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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(C)C)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(C)C)O)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C26H26ClN3O6S2/c1-15(38(35,36)19-11-9-18(37-4)10-12-19)24(32)28-21-14-23(31)22(13-20(21)27)29-25(33)16-5-7-17(8-6-16)26(34)30(2)3/h5-15,31H,1-4H3,(H,28,32)(H,29,33)