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6,6-bis(4-chlorophenyl)-1,3-diethyl-2-sulfanylidene-5H-furo[2,3-d]pyrimidin-4-one
SpectraBase Compound ID H9bKjdnLBtJ
InChI InChI=1S/C22H20Cl2N2O2S/c1-3-25-19(27)18-13-22(14-5-9-16(23)10-6-14,15-7-11-17(24)12-8-15)28-20(18)26(4-2)21(25)29/h5-12H,3-4,13H2,1-2H3
InChIKey FSTCMNMOYZYWSM-UHFFFAOYSA-N
Mol Weight 447.38 g/mol
Molecular Formula C22H20Cl2N2O2S
Exact Mass 446.062254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1kVzkpkDuvA
Name 6,6-bis(4-chlorophenyl)-1,3-diethyl-2-sulfanylidene-5H-furo[2,3-d]pyrimidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20Cl2N2O2S
InChI InChI=1S/C22H20Cl2N2O2S/c1-3-25-19(27)18-13-22(14-5-9-16(23)10-6-14,15-7-11-17(24)12-8-15)28-20(18)26(4-2)21(25)29/h5-12H,3-4,13H2,1-2H3
InChIKey FSTCMNMOYZYWSM-UHFFFAOYSA-N
Molecular Weight 447.380 g/mol
SMILES C12=C(C(=O)N(C(N2CC)=S)CC)CC(O1)(c1ccc(cc1)Cl)c1ccc(cc1)Cl
SPLASH splash10-0002-0020900000-2ee5681e994080240322
Source of Spectrum H1-54-181-8
Synonyms 6,6-bis(4-chlorophenyl)-1,3-diethyl-2-thioxo-5H-furo[2,3-d]pyrimidin-4-one
Wiley ID 1564234