N-[(5-Bromo-2-thienyl)methyl]adenosine

CAS Registry Number®

1706525-09-8
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CAS Name

N-[(5-Bromo-2-thienyl)methyl]adenosine

Molecular Formula

C15H16BrN5O4S

Molecular Mass

442.29

Cite this Page

N-[(5-Bromo-2-thienyl)methyl]adenosine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1706525-09-8 (retrieved 2024-09-10) (CAS RN: 1706525-09-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H16BrN5O4S/c16-9-2-1-7(26-9)3-17-13-10-14(19-5-18-13)21(6-20-10)15-12(24)11(23)8(4-22)25-15/h1-2,5-6,8,11-12,15,22-24H,3-4H2,(H,17,18,19)/t8-,11-,12-,15-/m1/s1

InChIKey

InChIKey=NMCXSKQZGXWJCZ-PMXXHBEXSA-N

SMILES

O[C@H]1[C@H](N2C=3C(N=C2)=C(NCC=4SC(Br)=CC4)N=CN3)O[C@H](CO)[C@H]1O

Canonical SMILES

BrC=1SC(=CC1)CNC2=NC=NC3=C2N=CN3C4OC(CO)C(O)C4O

Other Names for this Substance

  • Adenosine, N-[(5-bromo-2-thienyl)methyl]-
  • N-[(5-Bromo-2-thienyl)methyl]adenosine