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4,4-Dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxidanylidene-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide
SpectraBase Compound ID Adpi3UxxCzz
InChI InChI=1S/C27H33N3O3S/c1-27(2)18-23(28-12-13-30-14-16-32-17-15-30)25(24(31)19-27)26(34)29-20-8-10-22(11-9-20)33-21-6-4-3-5-7-21/h3-11,28H,12-19H2,1-2H3,(H,29,34)
InChIKey WQZSVCFCDBFKFB-UHFFFAOYSA-N
Mol Weight 479.6 g/mol
Molecular Formula C27H33N3O3S
Exact Mass 479.224263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQClXfPzDJO
Name 4,4-Dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxidanylidene-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H33N3O3S
InChI InChI=1S/C27H33N3O3S/c1-27(2)18-23(28-12-13-30-14-16-32-17-15-30)25(24(31)19-27)26(34)29-20-8-10-22(11-9-20)33-21-6-4-3-5-7-21/h3-11,28H,12-19H2,1-2H3,(H,29,34)
InChIKey WQZSVCFCDBFKFB-UHFFFAOYSA-N
Molecular Weight 479.639 g/mol
SMILES N(C(C1=C(CC(CC1=O)(C)C)NCCN1CCOCC1)=S)c1ccc(Oc2ccccc2)cc1
SPLASH splash10-0ufr-9821000000-4f3955741e5311825115
Synonyms 4,4-Dimethyl-2-(2-morpholin-4-ylethylamino)-6-oxo-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide 4,4-Dimethyl-2-(2-morpholinoethylamino)-6-oxo-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide 4,4-Dimethyl-2-[2-(4-morpholinyl)ethylamino]-6-oxo-N-(4-phenoxyphenyl)-1-cyclohexenecarbothioamide 6-keto-4,4-dimethyl-2-(2-morpholinoethylamino)-N-(4-phenoxyphenyl)cyclohexene-1-carbothioamide
Wiley ID 1512239