4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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![4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/801b84d9da1b4c2aa6954deb33c6c863.png "4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid")
4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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CAS No:
25313-09-1
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Formula:
C22H29ClFN7O7S2
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Chemical Name:
4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid
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Synonyms:
25313-09-1;NSC120924;DTXSID50298132;NSC-120924;Ethanesulfonic acid,6-diamino-2,2-dimethyl-s-triazin-1(2H)-yl)phenoxy]ethyl]carbamoyl]sulfanilyl fluoride (1:1) (8CI) (MF2);Ethanesulfonic acid--4-[({2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1(2H)-yl)phenoxy]ethyl}carbamoyl)amino]benzene-1-sulfonyl fluoride (1/1)
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CAS No:
4-[2-[2-chloro-4-(4,6-diamino-2,2-dimethyl-1,3,5-triazin-1-yl)phenoxy]ethylcarbamoylamino]benzenesulfonyl fluoride;ethanesulfonic acid Basic Attributes
622.1 g/mol
621.1242445 g/mol
120924
DTXSID50298132
Computed Properties
Molecular Weight:622.1
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:8
Exact Mass:621.1242445
Monoisotopic Mass:621.1242445
Topological Polar Surface Area:236
Heavy Atom Count:40
Complexity:1010
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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