SpectraBase Spectrum ID |
HPktvdtjNMi |
Name |
(R,S)-2-[[3-(Cyanomethyl)-3,4-dihydro-4-oxothieno[3,2-d]pyrimidine-2-yl]thio]propionic acid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C11H9N3O3S2 |
InChI |
InChI=1S/C11H9N3O3S2/c1-6(10(16)17)19-11-13-7-2-5-18-8(7)9(15)14(11)4-3-12/h2,5-6H,4H2,1H3,(H,16,17)/t6-/m1/s1 |
InChIKey |
PJMIAKVTHJXUKJ-ZCFIWIBFSA-N |
Molecular Weight |
295.331 g/mol |
SMILES |
OC([C@](SC=1N(C(=O)c2c(N1)ccs2)CC#N)(C)[H])=O |
SPLASH |
splash10-00xr-0490000000-ba937c87c846e994fed7 |
Source of Spectrum |
J-66-4726-7 |
Synonyms |
(2R)-2-{[3-(cyanomethyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}propanoic acid |
Wiley ID |
1535569 |