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Home > Encyclopedia > 4-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

4-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile structure

4-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile 

structure
  • CAS No:

    849030-18-8

  • Formula:

    C20H18N4S

  • Chemical Name:

    4-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

  • Synonyms:

    ZINC2454086;STL055923;AKOS005708896;MCULE-2121113475;4-({[4-allyl-5-(3-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile;4-({[5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)benzonitrile;849030-18-8

4-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile Basic Attributes

346.5 g/mol

346.12521776 g/mol

Characteristics

79.8 Ų

Computed Properties

Molecular Weight:346.5
XLogP3:4.3
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:346.12521776
Monoisotopic Mass:346.12521776
Topological Polar Surface Area:79.8
Heavy Atom Count:25
Complexity:479
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 4-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanylmethyl]benzonitrile

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