Catalog Number:
AG0004U2
Chemical Name:
Adenosine, N-[2-(3-thienyl)ethyl]- (9CI)
CAS Number:
101565-80-4
Molecular Formula:
C16H19N5O4S
Molecular Weight:
377.4182
IUPAC Name:
(2R,3S,4R,5R)-2-(hydroxymethyl)-5-[6-(2-thiophen-3-ylethylamino)purin-9-yl]oxolane-3,4-diol
InChI:
InChI=1S/C16H19N5O4S/c22-5-10-12(23)13(24)16(25-10)21-8-20-11-14(18-7-19-15(11)21)17-3-1-9-2-4-26-6-9/h2,4,6-8,10,12-13,16,22-24H,1,3,5H2,(H,17,18,19)/t10-,12-,13-,16-/m1/s1
InChI Key:
ICWJJMYDWRZACR-XNIJJKJLSA-N
SMILES:
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1cnc2c1ncnc2NCCc1cscc1