4H-Cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-3,5,6,7-tetrahydro-

SpectraBase Compound ID	I4S4oeg5aUa
InChI	InChI=1S/C17H13BrN2O2S2/c18-10-6-4-9(5-7-10)12(21)8-23-17-19-15(22)14-11-2-1-3-13(11)24-16(14)20-17/h4-7H,1-3,8H2,(H,19,20,22)
InChIKey	RODRMQBIWJCIIL-UHFFFAOYSA-N Google Search
Mol Weight	421.33 g/mol
Molecular Formula	C17H13BrN2O2S2
Exact Mass	419.960183 g/mol

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SpectraBase Spectrum ID	B28Wbz0jFEe
Name	4H-Cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one, 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-3,5,6,7-tetrahydro-
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H13BrN2O2S2
InChI	InChI=1S/C17H13BrN2O2S2/c18-10-6-4-9(5-7-10)12(21)8-23-17-19-15(22)14-11-2-1-3-13(11)24-16(14)20-17/h4-7H,1-3,8H2,(H,19,20,22)
InChIKey	RODRMQBIWJCIIL-UHFFFAOYSA-N
Molecular Weight	421.327 g/mol
SMILES	N1C(c2c(N=C1SCC(c1ccc(cc1)Br)=O)sc1CCCc21)=O
SPLASH	splash10-00ei-2910500000-a8d26252964b6d227a54
Source of Spectrum	IY-1-4606-5
Synonyms	3-[[2-(4-bromophenyl)-2-oxoethyl]thio]-2,6,7,8-tetrahydrocyclopenta[2,3]thieno[2,4-b]pyrimidin-1-one 3-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-2,6,7,8-tetrahydrocyclopenta[2,3]thieno[2,4-b]pyrimidin-1-one 3-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-2,6,7,8-tetrahydrocyclopenta[2,3]thieno[2,4-b]pyrimidin-1-one 3-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-2,6,7,8-tetrahydrocyclopenta[2,3]thieno[2,4-b]pyrimidin-1-one
Wiley ID	1654048