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2-(4-Bromophenyloxy)-3-(4-chlorophenyl)-5,6,7,8-tetrahydrobenzothieno[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID 6bw5Oy1uHn9
InChI InChI=1S/C22H16BrClN2O2S/c23-13-5-11-16(12-6-13)28-22-25-20-19(17-3-1-2-4-18(17)29-20)21(27)26(22)15-9-7-14(24)8-10-15/h5-12H,1-4H2
InChIKey GEKRDJQTGIXPOE-UHFFFAOYSA-N
Mol Weight 487.8 g/mol
Molecular Formula C22H16BrClN2O2S
Exact Mass 485.98044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Am4uYgQbbdM
Name 2-(4-Bromophenyloxy)-3-(4-chlorophenyl)-5,6,7,8-tetrahydrobenzothieno[2,3-d]pyrimidin-4(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16BrClN2O2S
InChI InChI=1S/C22H16BrClN2O2S/c23-13-5-11-16(12-6-13)28-22-25-20-19(17-3-1-2-4-18(17)29-20)21(27)26(22)15-9-7-14(24)8-10-15/h5-12H,1-4H2
InChIKey GEKRDJQTGIXPOE-UHFFFAOYSA-N
Molecular Weight 487.799 g/mol
SMILES c12c(N=C(N(C2=O)c2ccc(cc2)Cl)Oc2ccc(cc2)Br)sc2c1CCCC2
SPLASH splash10-000i-0222900000-60e02620dc958a72a697
Source of Spectrum C5-2004-78-6
Synonyms 2-(4-bromophenoxy)-3-(4-chlorophenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Wiley ID 1616350