CHEBI:104887 - 2-(2,4-dimethylanilino)-N-(thiophen-2-ylmethyl)-3-pyridinecarboxamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-(2,4-dimethylanilino)-N-(thiophen-2-ylmethyl)-3-pyridinecarboxamide
ChEBI ID CHEBI:104887
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C19H19N3OS
Net Charge 0
Average Mass 337.440
Monoisotopic Mass 337.12488
InChI InChI=1S/C19H19N3OS/c1-13-7-8-17(14(2)11-13)22-18-16(6-3-9-20-18)19(23)21-12-15-5-4-10-24-15/h3-11H,12H2,1-2H3,(H,20,22)(H,21,23)
InChIKey MNUHKAJKYNRNSN-UHFFFAOYSA-N
SMILES CC1=CC(=C(C=C1)NC2=C(C=CC=N2)C(=O)NCC3=CC=CS3)C
ChEBI Ontology
Outgoing 2-(2,4-dimethylanilino)-N-(thiophen-2-ylmethyl)-3-pyridinecarboxamide (CHEBI:104887) has functional parent nicotinamide (CHEBI:17154)
2-(2,4-dimethylanilino)-N-(thiophen-2-ylmethyl)-3-pyridinecarboxamide (CHEBI:104887) is a pyridinecarboxamide (CHEBI:25529)
Manual Xref Database
LSM-16249 LINCS
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