SpectraBase Spectrum ID |
3ImnNQVyTWW |
Name |
Ethyl Cyano[(4-benzoylmethylthio)-2H-1,3-benzoxazin-2-ylidene]acetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H16N2O4S |
InChI |
InChI=1S/C21H16N2O4S/c1-2-26-21(25)16(12-22)19-23-20(15-10-6-7-11-18(15)27-19)28-13-17(24)14-8-4-3-5-9-14/h3-11H,2,13H2,1H3/b19-16- |
InChIKey |
UQMOABSFQNSFRH-MNDPQUGUSA-N |
Molecular Weight |
392.429 g/mol |
SMILES |
C1(=N\C(Oc2c1cccc2)=C\(C(=O)OCC)C#N)SCC(=O)c1ccccc1 |
SPLASH |
splash10-052f-0609000000-9db7de17fe435c7098a0 |
Source of Spectrum |
O1-63-2327-11 |
Synonyms |
Ethyl (2Z)-cyano{4-[(2-oxo-2-phenylethyl)sulfanyl]-2H-1,3-benzoxazin-2-ylidene}ethanoate |
Wiley ID |
1592837 |