6-(butan-2-yl)-1-(4-methoxyphenyl)-2-sulfanylidene-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidin-4-one

SpectraBase Compound ID	FqdKPoUhQRG
InChI	InChI=1S/C17H22N4O2S/c1-4-11(2)20-9-14-15(18-10-20)21(17(24)19-16(14)22)12-5-7-13(23-3)8-6-12/h5-8,11,18H,4,9-10H2,1-3H3,(H,19,22,24)
InChIKey	WFBOZAFHPTVTQJ-UHFFFAOYSA-N Google Search
Mol Weight	346.45 g/mol
Molecular Formula	C17H22N4O2S
Exact Mass	346.146347 g/mol

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SpectraBase Spectrum ID	F90QibNbAIe
Name	6-(butan-2-yl)-1-(4-methoxyphenyl)-2-sulfanylidene-1H,2H,3H,4H,5H,6H,7H,8H-[1,3]diazino[4,5-d]pyrimidin-4-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H22N4O2S
InChI	InChI=1S/C17H22N4O2S/c1-4-11(2)20-9-14-15(18-10-20)21(17(24)19-16(14)22)12-5-7-13(23-3)8-6-12/h5-8,11,18H,4,9-10H2,1-3H3,(H,19,22,24)
InChIKey	WFBOZAFHPTVTQJ-UHFFFAOYSA-N
Molecular Weight	346.449 g/mol
SMILES	N1C(N(C2=C(C1=O)CN(CN2)C(C)CC)c1ccc(cc1)OC)=S
SPLASH	splash10-0a4l-9531000000-e8a8aa3b85bb5ba31913
Source of Spectrum	IY-2-5081-0
Synonyms	Pyrimido[4,5-d]pyrimidin-4(1H)-one, 2,3,5,6,7,8-hexahydro-1-(4-methoxyphenyl)-6-(1-methylpropyl)-2-thioxo- 6-Butan-2-yl-1-(4-methoxyphenyl)-2-sulfanylidene-7,8-dihydro-5H-pyrimido[4,5-d]pyrimidin-4-one
Wiley ID	1658793