2-[3-bromanyl-4-(naphthalen-1-ylmethoxy)phenyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one

SpectraBase Compound ID	HuL7d9tyxz9
InChI	InChI=1S/C27H21BrN2O2S/c28-21-14-17(25-29-26(31)24-20-10-3-4-11-23(20)33-27(24)30-25)12-13-22(21)32-15-18-8-5-7-16-6-1-2-9-19(16)18/h1-2,5-9,12-14H,3-4,10-11,15H2,(H,29,30,31)
InChIKey	SAQFIHYPPWWZGY-UHFFFAOYSA-N Google Search
Mol Weight	517.44 g/mol
Molecular Formula	C27H21BrN2O2S
Exact Mass	516.050712 g/mol

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SpectraBase Spectrum ID	CwEmcGg9qxv
Name	2-[3-bromanyl-4-(naphthalen-1-ylmethoxy)phenyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C27H21BrN2O2S
InChI	InChI=1S/C27H21BrN2O2S/c28-21-14-17(25-29-26(31)24-20-10-3-4-11-23(20)33-27(24)30-25)12-13-22(21)32-15-18-8-5-7-16-6-1-2-9-19(16)18/h1-2,5-9,12-14H,3-4,10-11,15H2,(H,29,30,31)
InChIKey	SAQFIHYPPWWZGY-UHFFFAOYSA-N
Molecular Weight	517.441 g/mol
SMILES	Oc1c2c(nc(n1)-c1cc(Br)c(cc1)OCc1c3c(cccc3)ccc1)sc1CCCCc21
SPLASH	splash10-0006-0900000000-d4d189d1174b6544d465
Synonyms	2-[3-bromo-4-(1-naphthalenylmethoxy)phenyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one 2-[3-bromo-4-(1-naphthylmethoxy)phenyl]-5,6,7,8-tetrahydro-3H-benzothiopheno[2,3-d]pyrimidin-4-one 2-[3-bromo-4-(naphthalen-1-ylmethoxy)phenyl]-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-4-one
Wiley ID	1454640