CHEBI:107727 - 3-(2,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)-2-propenamide

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-(2,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)-2-propenamide
ChEBI ID CHEBI:107727
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C16H17NOS
Net Charge 0
Average Mass 271.379
Monoisotopic Mass 271.10309
InChI InChI=1S/C16H17NOS/c1-12-5-6-14(13(2)10-12)7-8-16(18)17-11-15-4-3-9-19-15/h3-10H,11H2,1-2H3,(H,17,18)
InChIKey JLJNSMHAAKJHQC-UHFFFAOYSA-N
SMILES CC1=CC(=C(C=C1)C=CC(=O)NCC2=CC=CS2)C
ChEBI Ontology
Outgoing 3-(2,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)-2-propenamide (CHEBI:107727) is a cinnamamides (CHEBI:23247)
3-(2,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)-2-propenamide (CHEBI:107727) is a secondary carboxamide (CHEBI:140325)
Manual Xref Database
LSM-19105 LINCS
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Last Modified
07 March 2018