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Home > Encyclopedia > 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-3-oxobutanenitrile

2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-3-oxobutanenitrile

2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-3-oxobutanenitrile structure

2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-3-oxobutanenitrile 

structure
  • CAS No:

    757208-30-3

  • Formula:

    C23H18N4O3S

  • Chemical Name:

    2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-3-oxobutanenitrile

  • Synonyms:

    HMS1774G21;ZINC2618515;AKOS034470027;MCULE-2674881802;SR-01000054916;SR-01000054916-1;Z56999941;2-(1,3-dimethyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene)-4-{2,2-dioxo-2lambda6-thia-3-azatricyclo[6.3.1.0^{4,12}]dodeca-1(11),4(12),5,7,9-pentaen-3-yl}-3-oxobutanenitrile;757208-30-3

2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-3-oxobutanenitrile Basic Attributes

430.5 g/mol

430.10996162 g/mol

Characteristics

93.1 Ų

Computed Properties

Molecular Weight:430.5
XLogP3:3.5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:430.10996162
Monoisotopic Mass:430.10996162
Topological Polar Surface Area:93.1
Heavy Atom Count:31
Complexity:926
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of 2-(1,3-dimethylbenzimidazol-2-ylidene)-4-(2,2-dioxo-2λ6-thia-3-azatricyclo[6.3.1.04,12]dodeca-1(11),4,6,8(12),9-pentaen-3-yl)-3-oxobutanenitrile

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