Home > Product Catalog > Product category > Nucleoside > [[(2S,5R)-5-[4-Amino-2-oxo-5-[2-[4-[2-[(2,2,2-trifluoroacetyl)amino]ethoxy]phenyl]ethynyl]-1(2H)-pyrimidinyl]tetrahydro-2-furanyl]methoxy]hydroxyphosphinyl 1H-imidazole-1-carboxylate

[[(2S,5R)-5-[4-Amino-2-oxo-5-[2-[4-[2-[(2,2,2-trifluoroacetyl)amino]ethoxy]phenyl]ethynyl]-1(2H)-pyrimidinyl]tetrahydro-2-furanyl]methoxy]hydroxyphosphinyl 1H-imidazole-1-carboxylate

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Catalog No. : NC411901

CAS No. : 1057665-93-6

Product Level :

Brand : NewCan Bio

Molecular Formula : C₂₅H₂₃F₃N₆O₉P

Chemical Name : [[(2S,5R)-5-[4-Amino-2-oxo-5-[2-[4-[2-[(2,2,2-trifluoroacetyl)amino]ethoxy]phenyl]ethynyl]-1(2H)-pyrimidinyl]tetrahydro-2-furanyl]methoxy]hydroxyphosphinyl 1H-imidazole-1-carboxylate

Molecular Weight : 639.45

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Basic information

Standard English name
Cas No.	1057665-93-6
Alias	2-((((2S,5R)-5-(4-amino-2-oxo-5-((4-(2-(2,2,2-trifluoroacetamido)ethoxy)phenyl)ethynyl)pyrimidin-1(2H)-yl)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)-1H-imidazole-1-carboxylate
Canonical Smiles	NC1=NC(=O)N(C=C1C#CC1C=CC(=CC=1)OCCNC(=O)C(F)(F)F)[C@H]1CC[C@@H](COP(O)(=O)C2=NC=CN2C([O-])=O)O1
MDL No.
Exact Mass	639.12162
Smiles	O=C(N1C=CN=C1P(O)(OC[C@H]2O[C@@H](N3C=C(C#CC4=CC=C(OCCNC(C(F)(F)F)=O)C=C4)C(N)=NC3=O)CC2)=O)[O-]

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Inchi	InChI=1S/C25H24F3N6O9P/c26-25(27,28)21(35)30-10-12-41-17-5-2-15(3-6-17)1-4-16-13-34(22(36)32-20(16)29)19-8-7-18(43-19)14-42-44(39,40)23-31-9-11-33(23)24(37)38/h2-3,5-6,9,11,13,18-19H,7-8,10,12,14H2,(H,30,35)(H,37,38)(H,39,40)(H2,29,32,36)/p-1/t18-,19+/m0/s1
InchiKey	YEEDCSFADZYNLE-RBUKOAKNSA-M
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History

NC412278

5'-S-(2-Chlorophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-5'-thioadenosine