3-acetamido-N-[5-chloranyl-4-[2-(4-methylsulfanylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]benzamide

Systemtic Name: 3-acetamido-N-[5-chloranyl-4-[2-(4-methylsulfanylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]benzamide Openeye Name: 3-acetamido-N-[5-chloro-2-hydroxy-4-[2-(4-methylsulfanylphenyl)sulfonylbutanoylamino]phenyl]benzamide CAS Name: 3-acetamido-N-[5-chloro-2-hydroxy-4-[[2-[4-(methylthio)phenyl]sulfonyl-1-oxobutyl]amino]phenyl]benzamide IUPAC Name: 3-acetamido-N-[5-chloro-2-hydroxy-4-[2-(4-methylsulfanylphenyl)sulfonylbutanoylamino]phenyl]benzamide Traditional Name: 3-acetamido-N-[5-chloro-2-hydroxy-4-[2-[4-(methylthio)phenyl]sulfonylbutanoylamino]phenyl]benzamide Formula: C26H26ClN3O6S2 MolecularWeight: 576.08414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26ClN3O6S2/c1-4-24(38(35,36)19-10-8-18(37-3)9-11-19)26(34)29-21-14-23(32)22(13-20(21)27)30-25(33)16-6-5-7-17(12-16)28-15(2)31/h5-14,24,32H,4H2,1-3H3,(H,28,31)(H,29,34)(H,30,33)