CHEBI:149975 - (5-Chloropyridin-3-yl) 1-(3-nitrophenyl)sulfonylindole-5-carboxylate

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ChEBI Name (5-Chloropyridin-3-yl) 1-(3-nitrophenyl)sulfonylindole-5-carboxylate
ChEBI ID CHEBI:149975
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C20H12ClN3O6S
Net Charge 0
Average Mass 457.840
Monoisotopic Mass 457.01353
InChI InChI=1S/C20H12ClN3O6S/c21-15-9-17(12-22-11-15)30-20(25)14-4-5-19-13(8-14)6-7-23(19)31(28,29)18-3-1-2-16(10-18)24(26)27/h1-12H
InChIKey LXKXHISGOOZAGB-UHFFFAOYSA-N
SMILES C=1C=2N(C=CC2C=C(C1)C(OC=3C=NC=C(C3)Cl)=O)S(=O)(=O)C4=CC=CC(=C4)[N+](=O)[O-]
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): anticoronaviral agent
Any antiviral agent which inhibits the activity of coronaviruses.
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ChEBI Ontology
Outgoing (5-Chloropyridin-3-yl) 1-(3-nitrophenyl)sulfonylindole-5-carboxylate (CHEBI:149975) has role anticoronaviral agent (CHEBI:149553)
(5-Chloropyridin-3-yl) 1-(3-nitrophenyl)sulfonylindole-5-carboxylate (CHEBI:149975) is a indolyl carboxylic acid (CHEBI:46867)
General Comment
2020-05-22 anti-coronaviral activity data of this compound obtained from ChEMBL