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3(3-methoxyPhenyl)-2-thio-5,6,7,8,-tetrahydrobenzo[b]thieno[2,3-d]pyrimidin-4-(3H)-one
SpectraBase Compound ID AlEtBmeq2mF
InChI InChI=1S/C17H16N2O2S2/c1-21-11-8-6-10(7-9-11)19-16(20)14-12-4-2-3-5-13(12)23-15(14)18-17(19)22/h6-9H,2-5H2,1H3,(H,18,22)
InChIKey LYQDUKIEWRXIQB-UHFFFAOYSA-N
Mol Weight 344.45 g/mol
Molecular Formula C17H16N2O2S2
Exact Mass 344.06532 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KyOCOZOTmOr
Name 3(3-methoxyPhenyl)-2-thio-5,6,7,8,-tetrahydrobenzo[b]thieno[2,3-d]pyrimidin-4-(3H)-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O2S2
InChI InChI=1S/C17H16N2O2S2/c1-21-11-8-6-10(7-9-11)19-16(20)14-12-4-2-3-5-13(12)23-15(14)18-17(19)22/h6-9H,2-5H2,1H3,(H,18,22)
InChIKey LYQDUKIEWRXIQB-UHFFFAOYSA-N
Molecular Weight 344.447 g/mol
SMILES N1c2c(C(N(C1=S)c1ccc(cc1)OC)=O)c1c(s2)CCCC1
SPLASH splash10-00di-0093000000-b041658a21206bac0520
Source of Spectrum F2-45-5939-4
Synonyms 2-Mercapto-3-(4-methoxy-phenyl)-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one [1]Benzothieno[2,3-d]pyrimidin-4(1H)-one,2,3,5,6,7,8-hexahydro-3-(4-methoxyphenyl)-2-thioxo- 2-Mercapto-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro-3H-benzo[4,5]thieno[2,3-d]pyrimidin-4-one 3-(4-methoxyphenyl)-2-sulfanylidene-5,6,7,8-tetrahydro-1H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Wiley ID 1703373