5-(4-CHLOROPHENYL)-8,8-DIMETHYL-5,6,7,8,9,10-HEXAHYDRO-2-METHYLTHIO-PYRIMIDO-[4,5-B]-QUINOLINE-4,6-DIONE

SpectraBase Compound ID	3nlDUXksE7z
InChI	InChI=1S/C20H20ClN3O2S/c1-20(2)8-12-15(13(25)9-20)14(10-4-6-11(21)7-5-10)16-17(22-12)23-19(27-3)24-18(16)26/h4-7,14H,8-9H2,1-3H3,(H2,22,23,24,26)
InChIKey	ZMYPFBCXMULJNO-UHFFFAOYSA-N Google Search
Mol Weight	401.91 g/mol
Molecular Formula	C20H20ClN3O2S
Exact Mass	401.096476 g/mol

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SpectraBase Spectrum ID	4XkNZwQIEbO
Name	5-(4-Chlorophenyl)-8,8-dimethyl-2-(methylsulfanyl)-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Alternate Name(s)	5-(4-Chlorophenyl)-8,8-dimethyl-2-(methylthio)-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione 5-(4-Chlorophenyl)-8,8-dimethyl-2-(methylthio)-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-quinone 5-(4-Chlorophenyl)-8,8-dimethyl-2-methylsulfanyl-5,7,9,10-tetrahydro-1H-pyrimido[4,5-b]quinoline-4,6-dione
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H20ClN3O2S
InChI	InChI=1S/C20H20ClN3O2S/c1-20(2)8-12-15(13(25)9-20)14(10-4-6-11(21)7-5-10)16-17(22-12)23-19(27-3)24-18(16)26/h4-7,14H,8-9H2,1-3H3,(H2,22,23,24,26)
InChIKey	ZMYPFBCXMULJNO-UHFFFAOYSA-N
Molecular Weight	401.912 g/mol
SMILES	N1C(C=2C(C3=C(CC(CC3=O)(C)C)NC2N=C1SC)c1ccc(cc1)Cl)=O
SPLASH	splash10-0006-2090000000-0865244e8f3d6b926f18
Source of Spectrum	Y-35-233-4
Wiley ID	1369938