CHEBI:105182 - 3-[2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-1,3-benzothiazol-3-yl]-1-propanesulfonic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-[2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-1,3-benzothiazol-3-yl]-1-propanesulfonic acid
ChEBI ID CHEBI:105182
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C15H16N2O4S4
Net Charge 0
Average Mass 416.563
Monoisotopic Mass 415.99929
InChI InChI=1S/C15H16N2O4S4/c1-2-16-13(18)12(24-15(16)22)14-17(8-5-9-25(19,20)21)10-6-3-4-7-11(10)23-14/h3-4,6-7H,2,5,8-9H2,1H3,(H,19,20,21)
InChIKey ZHNBFYMZDUSWSL-UHFFFAOYSA-N
SMILES CCN1C(=O)C(=C2N(C3=CC=CC=C3S2)CCCS(=O)(=O)O)SC1=S
ChEBI Ontology
Outgoing 3-[2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-1,3-benzothiazol-3-yl]-1-propanesulfonic acid (CHEBI:105182) is a benzothiazoles (CHEBI:37947)
Manual Xref Database
LSM-16545 LINCS
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