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3-Isobutyl-6,6-dimethyl-2-(2-oxo-2-phenyl-ethylsulfanyl)-3,5,6,8-tetrahydro-7-oxa-9-thia-1,3-diaza-fluoren-4-one
SpectraBase Compound ID Fo3pXvi9Dol
InChI InChI=1S/C23H26N2O3S2/c1-14(2)11-25-21(27)19-16-10-23(3,4)28-12-18(16)30-20(19)24-22(25)29-13-17(26)15-8-6-5-7-9-15/h5-9,14H,10-13H2,1-4H3
InChIKey CDFVBHZZWUJHKK-UHFFFAOYSA-N
Mol Weight 442.59 g/mol
Molecular Formula C23H26N2O3S2
Exact Mass 442.138485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3RBpqCGEVQB
Name 3-Isobutyl-6,6-dimethyl-2-(2-oxo-2-phenyl-ethylsulfanyl)-3,5,6,8-tetrahydro-7-oxa-9-thia-1,3-diaza-fluoren-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N2O3S2
InChI InChI=1S/C23H26N2O3S2/c1-14(2)11-25-21(27)19-16-10-23(3,4)28-12-18(16)30-20(19)24-22(25)29-13-17(26)15-8-6-5-7-9-15/h5-9,14H,10-13H2,1-4H3
InChIKey CDFVBHZZWUJHKK-UHFFFAOYSA-N
Molecular Weight 442.592 g/mol
SMILES c12c(N=C(N(C2=O)CC(C)C)SCC(=O)c2ccccc2)sc2c1CC(OC2)(C)C
SPLASH splash10-0a4l-3914500000-bb67812fefd78cff0bce
Synonyms 3-Isobutyl-6,6-dimethyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one 6,6-Dimethyl-3-(2-methylpropyl)-2-(phenacylthio)-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one 3-isobutyl-6,6-dimethyl-2-phenacylsulfanyl-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one 6,6-Dimethyl-3-(2-methylpropyl)-2-phenacylsulfanyl-5,8-dihydropyrano[2,3]thieno[2,4-b]pyrimidin-4-one
Wiley ID 1457762