Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
CHEBI:105031 - 2-methoxy-4-(methylthio)-N-pyridin-4-ylbenzamide
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
2-methoxy-4-(methylthio)-N-pyridin-4-ylbenzamide
ChEBI ID
CHEBI:105031
Stars
This entity has been manually annotated by a third party.
Supplier Information
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
Formula
C14H14N2O2S
Net Charge
0
Average Mass
274.340
Monoisotopic Mass
274.07760
InChI
InChI=1S/C14H14N2O2S/c1-18-13-9-11(19-2)3-4-12(13)14(17)16-10-5-7-15-8-6-10/h3-9H,1-2H3,(H,15,16,17)
InChIKey
PPEQZNIWAAFDHQ-UHFFFAOYSA-N
SMILES
COC1=C(C=CC(=C1)SC)C(=O)NC2=CC=NC=C2
ChEBI Ontology
Outgoing
2-methoxy-4-(methylthio)-N-pyridin-4-ylbenzamide (
CHEBI:105031
)
is a
carbonyl compound (
CHEBI:36586
)
2-methoxy-4-(methylthio)-N-pyridin-4-ylbenzamide (
CHEBI:105031
)
is a
thiol (
CHEBI:29256
)
Manual Xref
Database
LSM-16394
LINCS
View more database links