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Home > Encyclopedia > methyl 5-[(4-tert-butylbenzoyl)carbamothioylamino]-4-cyano-3-methylthiophene-2-carboxylate

methyl 5-[(4-tert-butylbenzoyl)carbamothioylamino]-4-cyano-3-methylthiophene-2-carboxylate

methyl 5-[(4-tert-butylbenzoyl)carbamothioylamino]-4-cyano-3-methylthiophene-2-carboxylate structure

methyl 5-[(4-tert-butylbenzoyl)carbamothioylamino]-4-cyano-3-methylthiophene-2-carboxylate 

structure
  • CAS No:

    370586-58-6

  • Formula:

    C20H21N3O3S2

  • Chemical Name:

    methyl 5-[(4-tert-butylbenzoyl)carbamothioylamino]-4-cyano-3-methylthiophene-2-carboxylate

  • Synonyms:

    methyl 5-({[(4-tert-butylphenyl)carbonyl]carbamothioyl}amino)-4-cyano-3-methylthiophene-2-carboxylate;ZINC2312687;STK163501;AKOS003226417;MCULE-9517839071;370586-58-6

methyl 5-[(4-tert-butylbenzoyl)carbamothioylamino]-4-cyano-3-methylthiophene-2-carboxylate Basic Attributes

415.5 g/mol

415.10243389 g/mol

Characteristics

152 Ų

Computed Properties

Molecular Weight:415.5
XLogP3:5.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:415.10243389
Monoisotopic Mass:415.10243389
Topological Polar Surface Area:152
Heavy Atom Count:28
Complexity:659
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of methyl 5-[(4-tert-butylbenzoyl)carbamothioylamino]-4-cyano-3-methylthiophene-2-carboxylate

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