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917750-42-6

917750-42-6 structural image
Product Name: N-(4-(4-Ethyl-5-mercapto-4H-1,2,4-triazol-3-yl)phenyl)methanesulfonamide
Formula: C11H14N4O2S2
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COMPUTED DESCRIPTORS

Molecular Weight 298.4 g/mol
XLogP3 1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 4
Exact Mass 298.05581805 g/mol
Monoisotopic Mass 298.05581805 g/mol
Topological Polar Surface Area 114 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 475
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes