Formamide, N-((4-((3-(trifluoromethyl)phenyl)amino)-3-pyridinyl)sulfonyl)- (CHEBI:180605)

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	Formamide, N-((4-((3-(trifluoromethyl)phenyl)amino)-3-pyridinyl)sulfonyl)-

ChEBI ID	CHEBI:180605

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C13H10F3N3O3S

Net Charge

Average Mass

345.300

Monoisotopic Mass

345.03950

InChI

InChI=1S/C13H10F3N3O3S/c14-13(15,16)9-2-1-3-10(6-9)19-11-4-5-17-7-12(11)23(21,22)18-8-20/h1-8H,(H,17,19)(H,18,20)

InChIKey

AXRGGQNXQBMABA-UHFFFAOYSA-N

SMILES

S(=O)(=O)(NC=O)C1=C(NC=2C=C(C=CC2)C(F)(F)F)C=CN=C1

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in pancreas (BTO:0000988). of strain PANC-1 cell [BCGO:0000122] See: MetaboLights Study

ChEBI Ontology
Outgoing	Formamide, N-((4-((3-(trifluoromethyl)phenyl)amino)-3-pyridinyl)sulfonyl)- (CHEBI:180605) is a pyridines (CHEBI:26421) Formamide, N-((4-((3-(trifluoromethyl)phenyl)amino)-3-pyridinyl)sulfonyl)- (CHEBI:180605) is a sulfonamide (CHEBI:35358)

IUPAC Name

N-[4-[3-(triluoromethyl)anilino]pyridin-3-yl]sulonylormamide

Registry Number	Type	Source
56175-87-2	CAS Registry Number	ChemIDplus