SpectraBase Spectrum ID |
2iJ1AKIjZiT |
Name |
Ethyl (E)-2-(N'-{[2-(methoxycarbonyl)thien-3-yl]sulfonyl}acetimidamido)-1H-benzimidazole-5-carboxylate |
Appearance |
Colorless crystals |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H18N4O6S2 |
InChI |
InChI=1S/C18H18N4O6S2/c1-4-28-16(23)11-5-6-12-13(9-11)21-18(20-12)19-10(2)22-30(25,26)14-7-8-29-15(14)17(24)27-3/h5-9H,4H2,1-3H3,(H2,19,20,21,22) |
InChIKey |
QTHAVFNRADTQOI-UHFFFAOYSA-N |
Instrument Name |
Shimadzu GCMS-QP2010 Ultra |
Ionization Type |
EI |
Literature Reference DOI |
10.24820/ark.5550190.p010.200 |
Molecular Weight |
450.484 g/mol |
SMILES |
[nH]1c(nc2cc(ccc12)C(OCC)=O)N\C(C)=N\S(=O)(c1c(scc1)C(OC)=O)=O |
SPLASH |
splash10-03ds-1197000000-937473b093e0df06735f |
Source of Spectrum |
ARK-2017-235-4j |
Wiley ID |
1840889 |