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Home > Encyclopedia > 2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetonitrile

2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetonitrile

2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetonitrile structure

2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetonitrile 

structure
  • CAS No:

    314042-12-1

  • Formula:

    C15H15N3OS2

  • Chemical Name:

    2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetonitrile

  • Synonyms:

    Oprea1_223760;Oprea1_642432;ZINC2362143;STK831199;AKOS001627949;MCULE-8743295523;SR-01000431452;SR-01000431452-1;{[3-(2-methylallyl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl cyanide;{[3-(2-methylprop-2-en-1-yl)-4-oxo-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetonitrile;314042-12-1

2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetonitrile Basic Attributes

317.4 g/mol

317.06565446 g/mol

Characteristics

110 Ų

Computed Properties

Molecular Weight:317.4
XLogP3:3.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:317.06565446
Monoisotopic Mass:317.06565446
Topological Polar Surface Area:110
Heavy Atom Count:21
Complexity:550
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-[[11-(2-methylprop-2-enyl)-12-oxo-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9-trien-10-yl]sulfanyl]acetonitrile

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