Translations:Benfotiamine/1/ja

Benfotiamine/1/ja
Clinical data


Trade names	Milgamma
Other names	S-Benzoylthiamine O-monophosphate
AHFS/Drugs.com	International Drug Names
Routes of administration	Oral
ATC code	A11DA03 (WHO)
Legal status
Legal status	In general: Over-the-counter (OTC)
Identifiers
IUPAC name S-[2-{[(4-Amino-2-methylpyrimidin-5-yl)methyl] (formyl)amino}-5-(phosphonooxy)pent-2-en-3-yl] benzenecarbothioate
CAS Number	22457-89-2^Y
PubChem CID	3032771
ChemSpider	2297665^Y
UNII	Y92OUS2H9B
ChEBI	CHEBI:41039^N
ChEMBL	ChEMBL1491875^N
Chemical and physical data
Formula	C₁₉H₂₃N₄O₆PS
Molar mass	466.45 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES O=P(O)(O)OCCC(/SC(=O)c1ccccc1)=C(/N(C=O)Cc2cnc(nc2N)C)C
InChI InChI=1S/C19H23N4O6PS/c1-13(23(12-24)11-16-10-21-14(2)22-18(16)20)17(8-9-29-30(26,27)28)31-19(25)15-6-4-3-5-7-15/h3-7,10,12H,8-9,11H2,1-2H3,(H2,20,21,22)(H2,26,27,28)/b17-13-^Y Key:BTNNPSLJPBRMLZ-LGMDPLHJSA-N^Y
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