4-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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4-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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CAS No:
20092-07-3
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Formula:
C21H27ClFN7O6S2
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Chemical Name:
4-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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Synonyms:
20092-07-3;NSC120920;DTXSID40942117;NSC-120920;Ethanesulfonic acid,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenyl]methyl]amino]carbonyl]amino]benzenesulfonyl fluoride (1:1);Ethanesulfonic acid,6-diamino-2,2-dimethyl-s-triazin-1(2H)-yl)benzyl]ureido]benzenesulfonyl fluoride (1:1);Ethanesulfonic acid--N'-{[2-chloro-4-(4,6-diimino-2,2-dimethyl-1,3,5-triazinan-1-yl)phenyl]methyl}-N-[4-(fluorosulfonyl)phenyl]carbamimidic acid (1/1)
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CAS No:
4-[[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenyl]methylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid Basic Attributes
592.1 g/mol
591.1136798 g/mol
120920
Computed Properties
Molecular Weight:592.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:591.1136798
Monoisotopic Mass:591.1136798
Topological Polar Surface Area:226
Heavy Atom Count:38
Complexity:974
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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