Home > Product Catalog > Product category > Nucleoside > 8-Bromo-5'-[[2-[[5-(4-cyanophenyl)-1,3,4-oxadiazol-2-yl]amino]-2-oxoethyl]amino]-5'-deoxy-2-methylinosine

8-Bromo-5'-[[2-[[5-(4-cyanophenyl)-1,3,4-oxadiazol-2-yl]amino]-2-oxoethyl]amino]-5'-deoxy-2-methylinosine

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Catalog No. : NC291025

CAS No. : 1643688-50-9

Product Level :

Brand : NewCan Bio

Molecular Formula : C₂₂H₂₀BrN₉O₆

Chemical Name : 8-Bromo-5'-[[2-[[5-(4-cyanophenyl)-1,3,4-oxadiazol-2-yl]amino]-2-oxoethyl]amino]-5'-deoxy-2-methylinosine

Molecular Weight : 586.35

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Basic information

Standard English name
Cas No.	1643688-50-9
Alias	2-((((2R,3S,4R,5R)-5-(8-bromo-6-hydroxy-2-methyl-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl)amino)-N-(5-(4-cyanophenyl)-1,3,4-oxadiazol-2-yl)acetamide
Canonical Smiles	CC1=NC(O)=C2N=C(Br)N([C@@H]3O[C@H](CNCC(=O)NC4=NN=C(O4)C4C=CC(=CC=4)C#N)[C@@H](O)[C@H]3O)C2=N1
MDL No.
Exact Mass	585.07199
Smiles	O[C@@H]([C@H]([C@H](N1C(Br)=NC2=C(N=C(C)N=C21)O)O3)O)[C@H]3CNCC(NC4=NN=C(C5=CC=C(C#N)C=C5)O4)=O

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Inchi	InChI=1S/C22H20BrN9O6/c1-9-26-17-14(18(36)27-9)29-21(23)32(17)20-16(35)15(34)12(37-20)7-25-8-13(33)28-22-31-30-19(38-22)11-4-2-10(6-24)3-5-11/h2-5,12,15-16,20,25,34-35H,7-8H2,1H3,(H,26,27,36)(H,28,31,33)/t12-,15-,16-,20-/m1/s1
InchiKey	SPEPXJVDQDFAQY-VXHCAWKWSA-N
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