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  • [Synonyms]
    NSC142656
    AIDS032440
    AIDS-032440
    Acetamide, N-[4-[[[[(3-methylbutyl)amino]carbonyl]amino]sulfonyl]phenyl]-

    [Structure]

    [ Properties Computed from Structure]
    Molecular Weight327.39924 [g/mol]
    Molecular FormulaC14H21N3O4S
    XLogP1.5
    H-Bond Donor3
    H-Bond Acceptor4
    Rotatable Bond Count6
    Tautomer Count6
    Exact Mass327.125277
    MonoIsotopic Mass327.125277
    Topological Polar Surface Area104
    Heavy Atom Count22
    Formal Charge0
    Complexity477
    Isotope Atom Count0
    Defined Atom StereoCenter Count0
    Undefined Atom StereoCenter Count0
    Defined Bond StereoCenter Count0
    Undefined Bond StereoCenter Count0
    Covalently-Bonded Unit Count1

    [ Descriptors Computed from Structure]
    IUPAC Name: N-[4-(3-methylbutylcarbamoylsulfamoyl)phenyl]acetamide
    Canonical SMILES: CC(C)CCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C
    InChI: InChI=1/C14H21N3O4S/c1-10(2)8-9-15-14(19)17-22(20,
    21)13-6-4-12(5-7-13)16-11(3)18/h4-7,10H,8-9H2,1-3H3,(H,16,18)(H2,15,17,
    19)/f/h15-17H



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