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Concept information

... > chemical entity > molecular entity > ion > cation > organic cation > n-[1,4-dioxo-3-(1-pyridin-1-iumyl)-2-naphthalenyl]-2-thiophenesulfonamide
... > chemical entity > molecular entity > ion > organic ion > organic cation > n-[1,4-dioxo-3-(1-pyridin-1-iumyl)-2-naphthalenyl]-2-thiophenesulfonamide

Preferred term

n-[1,4-dioxo-3-(1-pyridin-1-iumyl)-2-naphthalenyl]-2-thiophenesulfonamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • +1

formula

  • C19H13N2O4S2

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

mass

  • 397.450

monoisotopicmass

  • 397.03113

smiles

  • C1=CC=[N+](C=C1)C2=C(C(=O)C3=CC=CC=C3C2=O)NS(=O)(=O)C4=CC=CS4

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:109161

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