CAS Registry Number:147126-73-6
Name:

5-(4-amino-2-oxo-1(2h)-pyrimidinyl)-1,3-oxathiolane-2-carboxylic acid 5-methyl-2-(1-methylethyl)cyclohexyl ester;

1,3-Oxathiolane-2-carboxylicacid, 5-(4-amino-2-oxo-1(2H)-pyrimidinyl)-,5-methyl-2-(1-methylethyl)cyclohexyl ester, [1R-[1a(2S*,5R*),2b,5b]]- (9CI); 2-isopropyl-5-methylcyclohexyl 5-(4-amino-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolane-2-carboxylate

Chemical Formula: C18H27N3O4S
Exact Mass: 381.17
Molecular Weight: 381.49
m/z: 381.17 (100.0%), 382.18 (19.9%), 383.17 (4.9%), 383.18 (2.7%), 382.17 (1.9%)

InChI
InChI=1S/C18H27N3O4S/c1-10(2)12-5-4-11(3)8-13(12)24-16(22)17-25-15(9-26-17)21-7-6-14(19)20-18(21)23/h6-7,10-13,15,17H,4-5,8-9H2,1-3H3,(H2,19,20,23)
InChI Key
QMYKWNYBSBURDT-UHFFFAOYSA-N
Canonical SMILES
CC1CCC(C(C1)OC(=O)C2OC(CS2)N3C=CC(=NC3=O)N)C(C)C

Specification

98%

Eur. Pat. Appl. (1992), EP 515157 A1 19921125.