3-(3-Oxo-5-thioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propanoic acid

SpectraBase Compound ID	2jKmKa1370G
InChI	InChI=1S/C9H5NO3S6/c11-3(12)1-2-10-4-6(13)16-18-8(4)15-9-5(10)7(14)17-19-9/h1-2H2,(H,11,12)
InChIKey	LONNXOCXCZGTDX-UHFFFAOYSA-N Google Search
Mol Weight	367.5 g/mol
Molecular Formula	C9H5NO3S6
Exact Mass	366.85937 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	ETxzv2rLAUK
Name	3-(3-Oxo-5-thioxo-3H,4H,5H-bis[1,2]dithiolo[3,4-b:4',3'-e][1,4]thiazin-4-yl)propanoic acid
Copyright	Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C9H5NO3S6
InChI	InChI=1S/C9H5NO3S6/c11-3(12)1-2-10-4-6(13)16-18-8(4)15-9-5(10)7(14)17-19-9/h1-2H2,(H,11,12)
InChIKey	LONNXOCXCZGTDX-UHFFFAOYSA-N
Molecular Weight	367.503 g/mol
SMILES	OC(CCN1C2=C(SC3=C1C(=S)SS3)SSC2=O)=O
SPLASH	splash10-014i-1109000000-c7613c06228a5816e566
Source of Spectrum	KC-0-3427-23
Synonyms	3-(3-oxo-5-thioxo-3H,4H,5H-di[1,2]dithiolo[3,4-b:4,3-e][1,4]thiazin-4-yl)propanoic acid 3-(5-oxo-3-sulfanylidene-4-didithiolo[5,4-a:5',4'-e][1,4]thiazinyl)propanoic acid 3-(5-oxo-3-sulfanylidenedidithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl)propanoic acid 3-(5-oxo-3-thioxo-didithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl)propanoic acid 3-(5-oxidanylidene-3-sulfanylidene-di[1,2]dithiolo[5,4-a:5',4'-e][1,4]thiazin-4-yl)propanoic acid
Wiley ID	831747