Carbonic acid, 4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-3-[(ethoxycarbonyl)thio]-3-penten-1-yl ethyl ester, hydrochloride (1:1)
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Carbonic acid, 4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-3-[(ethoxycarbonyl)thio]-3-penten-1-yl ethyl ester, hydrochloride (1:1)
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CAS No:
616-96-6
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Formula:
C18H26N4O6S.ClH
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Chemical Name:
Carbonic acid, 4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-3-[(ethoxycarbonyl)thio]-3-penten-1-yl ethyl ester, hydrochloride (1:1)
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Synonyms:
Carbonic acid,4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-3-[(ethoxycarbonyl)thio]-3-penten-1-yl ethyl ester,hydrochloride (1:1);Carbonic acid,thio-,O-ethyl ester,S-ester with N-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-N-(4-hydroxy-2-mercapto-1-methyl-1-butenyl)formamide ethyl carbonate (ester),monohydrochloride;Carbonic acid,4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-3-[(ethoxycarbonyl)thio]-3-pentenyl ethyl ester,monohydrochloride;O,S-Bis(ethoxycarbonyl)thiamine hydrochloride;Dicethiamine hydrochloride;O,S-Dicarboethoxythiamine hydrochloride;O,S-Dicarbethoxythiamine hydrochloride;Dicetamin;Dicarbethoxythiamine hydrochloride;16145-28-1
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CAS No:
Carbonic acid, 4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-3-[(ethoxycarbonyl)thio]-3-penten-1-yl ethyl ester, hydrochloride (1:1) Basic Attributes
462.94818
462.134
4Q9TEB340S
DTXSID2048793
Computed Properties
Molecular Weight:462.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:13
Exact Mass:462.1339835
Monoisotopic Mass:462.1339835
Topological Polar Surface Area:159
Heavy Atom Count:30
Complexity:589
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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Carbonic acid, 4-[[(4-amino-2-methyl-5-pyrimidinyl)methyl]formylamino]-3-[(ethoxycarbonyl)thio]-3-penten-1-yl ethyl ester, hydrochloride (1:1)
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