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N-(4-fluorophenyl)-4,4-dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxidanylidene-cyclohexene-1-carbothioamide
SpectraBase Compound ID Ju0AvwbIfEt
InChI InChI=1S/C21H28FN3O2S/c1-21(2)13-17(23-7-8-25-9-11-27-12-10-25)19(18(26)14-21)20(28)24-16-5-3-15(22)4-6-16/h3-6,23H,7-14H2,1-2H3,(H,24,28)
InChIKey SAZFNWTXRWNORV-UHFFFAOYSA-N
Mol Weight 405.53 g/mol
Molecular Formula C21H28FN3O2S
Exact Mass 405.188626 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3hK4D2PIrg
Name N-(4-fluorophenyl)-4,4-dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxidanylidene-cyclohexene-1-carbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28FN3O2S
InChI InChI=1S/C21H28FN3O2S/c1-21(2)13-17(23-7-8-25-9-11-27-12-10-25)19(18(26)14-21)20(28)24-16-5-3-15(22)4-6-16/h3-6,23H,7-14H2,1-2H3,(H,24,28)
InChIKey SAZFNWTXRWNORV-UHFFFAOYSA-N
Molecular Weight 405.532 g/mol
SMILES N(C(C1=C(CC(CC1=O)(C)C)NCCN1CCOCC1)=S)c1ccc(cc1)F
SPLASH splash10-0zfr-7932000000-7c02804155db6822c418
Synonyms N-(4-fluorophenyl)-4,4-dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxocyclohexene-1-carbothioamide N-(4-fluorophenyl)-4,4-dimethyl-2-(2-morpholinoethylamino)-6-oxo-cyclohexene-1-carbothioamide N-(4-fluorophenyl)-4,4-dimethyl-2-[2-(4-morpholinyl)ethylamino]-6-oxo-1-cyclohexenecarbothioamide N-(4-fluorophenyl)-4,4-dimethyl-2-{[2-(4-morpholinyl)ethyl]amino}-6-oxo-1-cyclohexene-1-carbothioamide N-(4-fluorophenyl)-6-keto-4,4-dimethyl-2-(2-morpholinoethylamino)cyclohexene-1-carbothioamide
Wiley ID 1444764