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Home > Encyclopedia > 3-[5-(cyanomethylsulfanyl)-4-(2,4,4-trimethylpentan-2-yl)-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide

3-[5-(cyanomethylsulfanyl)-4-(2,4,4-trimethylpentan-2-yl)-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide

3-[5-(cyanomethylsulfanyl)-4-(2,4,4-trimethylpentan-2-yl)-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide structure

3-[5-(cyanomethylsulfanyl)-4-(2,4,4-trimethylpentan-2-yl)-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide 

structure
  • CAS No:

    851789-07-6

  • Formula:

    C22H33N5O2S2

  • Chemical Name:

    3-[5-(cyanomethylsulfanyl)-4-(2,4,4-trimethylpentan-2-yl)-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide

  • Synonyms:

    ZINC3378963;AKOS033778189;MCULE-3103500325;Z21621865;3-{5-[(cyanomethyl)sulfanyl]-4-(2,4,4-trimethylpentan-2-yl)-4H-1,2,4-triazol-3-yl}-N,N-diethylbenzene-1-sulfonamide;851789-07-6

3-[5-(cyanomethylsulfanyl)-4-(2,4,4-trimethylpentan-2-yl)-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide Basic Attributes

463.7 g/mol

463.20756766 g/mol

Characteristics

126 Ų

Computed Properties

Molecular Weight:463.7
XLogP3:4.2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:463.20756766
Monoisotopic Mass:463.20756766
Topological Polar Surface Area:126
Heavy Atom Count:31
Complexity:731
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 3-[5-(cyanomethylsulfanyl)-4-(2,4,4-trimethylpentan-2-yl)-1,2,4-triazol-3-yl]-N,N-diethylbenzenesulfonamide

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