CHEBI:93041 - 3-amino-2-[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-3-mercapto-2-propenenitrile

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ChEBI Name 3-amino-2-[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-3-mercapto-2-propenenitrile
ChEBI ID CHEBI:93041
Stars This entity has been manually annotated by a third party.
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Formula C18H24N2OS
Net Charge 0
Average Mass 316.463
Monoisotopic Mass 316.16093
InChI InChI=1S/C18H24N2OS/c1-17(2,3)13-8-11(7-12(10-19)16(20)22)9-14(15(13)21)18(4,5)6/h7-9,22H,20H2,1-6H3
InChIKey LCUMYVYIHXYBIA-UHFFFAOYSA-N
SMILES CC(C)(C)C1=CC(=CC(=C(N)S)C#N)C=C(C1=O)C(C)(C)C
ChEBI Ontology
Outgoing 3-amino-2-[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-3-mercapto-2-propenenitrile (CHEBI:93041) is a monoterpenoid (CHEBI:25409)
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