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CHEBI:3218 - 2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one

ChEBI IDCHEBI:3218
ChEBI Name2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one
Stars
ASCII Name2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one
Last Modified28 November 2016
DownloadsMolfile
FormulaC16H23N3OS
Net Charge0
Average Mass305.447
Monoisotopic Mass305.15618
SMILESCC(C)N1C(=O)N(c2ccccc2)CSC1=NC(C)(C)C
InChIInChI=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
InChIKeyPRLVTUNWOQKEAI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one (CHEBI:3218) is a thiadiazinane (CHEBI:38781)
2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one (CHEBI:3218) is a ureas (CHEBI:47857)
Incoming Relation(s)
(E)-buprofezin (CHEBI:39380) is a 2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one (CHEBI:3218)
buprofezin (CHEBI:39381) is a 2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one (CHEBI:3218)
IUPAC Name 
2-(tert-butylimino)-5-phenyl-3-(propan-2-yl)-1,3,5-thiadiazinan-4-one
Synonyms  Source
BuprofezinKEGG COMPOUND
2-(tert-butylimino)-3-isopropyl-5-phenyl-1,3,5-thiadiazinan-4-oneIUPAC
buprofezinChEBI
Manual XrefsDatabases
C10912KEGG COMPOUND
Registry NumbersSources
Beilstein:1010518Beilstein
CAS:69327-76-0KEGG COMPOUND
CAS:69327-76-0ChemIDplus