CHEBI:109161 - N-[1,4-dioxo-3-(1-pyridin-1-iumyl)-2-naphthalenyl]-2-thiophenesulfonamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name N-[1,4-dioxo-3-(1-pyridin-1-iumyl)-2-naphthalenyl]-2-thiophenesulfonamide
ChEBI ID CHEBI:109161
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C19H13N2O4S2
Net Charge +1
Average Mass 397.450
Monoisotopic Mass 397.03113
InChI InChI=1S/C19H12N2O4S2/c22-18-13-7-2-3-8-14(13)19(23)17(21-10-4-1-5-11-21)16(18)20-27(24,25)15-9-6-12-26-15/h1-12H/p+1
InChIKey CMBUXPJABLCYJT-UHFFFAOYSA-O
SMILES C1=CC=[N+](C=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=CS4
ChEBI Ontology
Outgoing N-[1,4-dioxo-3-(1-pyridin-1-iumyl)-2-naphthalenyl]-2-thiophenesulfonamide (CHEBI:109161) is a organic cation (CHEBI:25697)
Manual Xref Database
LSM-20558 LINCS
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Last Modified
07 June 2016