SpectraBase Spectrum ID |
GSSek0x8tx5 |
Name |
Methyl 2-[1-benzyl-5-(methylsulfanyl)-4-nitro-2-oxo-1,2-dihydro-3H-pyrrol-3-yliden]acetate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H14N2O5S |
InChI |
InChI=1S/C15H14N2O5S/c1-22-12(18)8-11-13(17(20)21)15(23-2)16(14(11)19)9-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3/b11-8- |
InChIKey |
HJRACGNXJZWHBP-FLIBITNWSA-N |
Molecular Weight |
334.346 g/mol |
SMILES |
C=1(\C(C(=O)N(C1SC)Cc1ccccc1)=C\C(=O)OC)N(=O)=O |
SPLASH |
splash10-0006-9112000000-370a10479321cb109e67 |
Source of Spectrum |
Y-51-531-3j |
Synonyms |
(Z)-methyl 2-(1-benzyl-5-(methylthio)-4-nitro-2-oxo-1H-pyrrol-3(2H)-ylidene)acetate |
Wiley ID |
1741284 |