CHEBI:120426 - 2-cyano-N-cyclohexyl-3-[4-(methylthio)phenyl]-2-propenamide

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ChEBI Name 2-cyano-N-cyclohexyl-3-[4-(methylthio)phenyl]-2-propenamide
ChEBI ID CHEBI:120426
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H20N2OS
Net Charge 0
Average Mass 300.420
Monoisotopic Mass 300.12963
InChI InChI=1S/C17H20N2OS/c1-21-16-9-7-13(8-10-16)11-14(12-18)17(20)19-15-5-3-2-4-6-15/h7-11,15H,2-6H2,1H3,(H,19,20)
InChIKey SMPUOPSPJOHYOK-UHFFFAOYSA-N
SMILES CSC1=CC=C(C=C1)C=C(C#N)C(=O)NC2CCCCC2
ChEBI Ontology
Outgoing 2-cyano-N-cyclohexyl-3-[4-(methylthio)phenyl]-2-propenamide (CHEBI:120426) is a cinnamamides (CHEBI:23247)
2-cyano-N-cyclohexyl-3-[4-(methylthio)phenyl]-2-propenamide (CHEBI:120426) is a secondary carboxamide (CHEBI:140325)
Manual Xref Database
LSM-31869 LINCS
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Last Modified
07 March 2018