CHEBI:39380 - (E)-buprofezin

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ChEBI Name (E)-buprofezin
ChEBI ID CHEBI:39380
ChEBI ASCII Name (E)-buprofezin
Definition A 2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one in which the C=N double bond has E configuration.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C16H23N3OS
Net Charge 0
Average Mass 305.440
Monoisotopic Mass 305.15618
InChI InChI=1S/C16H23N3OS/c1-12(2)19-14(17-16(3,4)5)21-11-18(15(19)20)13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3/b17-14+
InChIKey PRLVTUNWOQKEAI-SAPNQHFASA-N
SMILES S/1CN(C=2C=CC=CC2)C(=O)N(\C1=N/C(C)(C)C)C(C)C
ChEBI Ontology
Outgoing (E)-buprofezin (CHEBI:39380) is a 2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one (CHEBI:3218)
IUPAC Name
(2E)-2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one
Synonym Source
(2E)-2-(tert-butylimino)-3-isopropyl-5-phenyl-1,3,5-thiadiazinan-4-one IUPAC
Registry Number Type Source
8324923 Beilstein Registry Number Beilstein
Last Modified
28 November 2016
General Comment
2016-11-26 The name "buprofezin" was originally approved for a mixture of (E)- and (Z)-isomers [69327-76-0], but in 2008 the sponsor determined that the substance contains only the (Z)-isomer and requested that the definition be changed.