3-[[2-[2-[2-[[2-[1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indol-3-yl]-2-oxoacetyl]amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl-dimethylsulfanium;iodide
-
![3-[[2-[2-[2-[[2-[1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indol-3-yl]-2-oxoacetyl]amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl-dimethylsulfanium;iodide structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5a0d13a1a9454eb9aa73774d751acc77.png "3-[[2-[2-[2-[[2-[1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indol-3-yl]-2-oxoacetyl]amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl-dimethylsulfanium;iodide")
3-[[2-[2-[2-[[2-[1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indol-3-yl]-2-oxoacetyl]amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl-dimethylsulfanium;iodide
structure -
-
CAS No:
188637-89-0
-
Formula:
C29H31ClIN5O4S3
-
Chemical Name:
3-[[2-[2-[2-[[2-[1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indol-3-yl]-2-oxoacetyl]amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl-dimethylsulfanium;iodide
-
Synonyms:
188637-89-0;SCHEMBL8180835;Sulfonium, (3-(((2'-(2-(((1-(chloromethyl)-1,2-dihydro-5-hydroxy-3H-benz(e)indol-3-yl)oxoacetyl)amino)ethyl)(2,4'-bithiazol)-4-yl)carbonyl)amino)propyl)dimethyl-, iodide, (S)-
-
CAS No:
3-[[2-[2-[2-[[2-[1-(chloromethyl)-5-hydroxy-1,2-dihydrobenzo[e]indol-3-yl]-2-oxoacetyl]amino]ethyl]-1,3-thiazol-4-yl]-1,3-thiazole-4-carbonyl]amino]propyl-dimethylsulfanium;iodide Basic Attributes
772.1 g/mol
771.02714 g/mol
Computed Properties
Molecular Weight:772.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:10
Exact Mass:771.02714
Monoisotopic Mass:771.02714
Topological Polar Surface Area:182
Heavy Atom Count:43
Complexity:966
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
Request for Quotation