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2-(ethylsulfanyl)-3-(4-methoxyphenyl)-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-(ethylsulfanyl)-3-(4-methoxyphenyl)-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
SpectraBase Compound ID F514uScYkaB
InChI InChI=1S/C21H23N3O3S/c1-5-28-20-23-18-16(10-13-12-27-21(2,3)11-17(13)22-18)19(25)24(20)14-6-8-15(26-4)9-7-14/h6-10H,5,11-12H2,1-4H3
InChIKey OHDJYXKSVRGPKA-UHFFFAOYSA-N
Mol Weight 397.49 g/mol
Molecular Formula C21H23N3O3S
Exact Mass 397.146013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JqyR1okLO85
Name 2-(ethylsulfanyl)-3-(4-methoxyphenyl)-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23N3O3S
InChI InChI=1S/C21H23N3O3S/c1-5-28-20-23-18-16(10-13-12-27-21(2,3)11-17(13)22-18)19(25)24(20)14-6-8-15(26-4)9-7-14/h6-10H,5,11-12H2,1-4H3
InChIKey OHDJYXKSVRGPKA-UHFFFAOYSA-N
Molecular Weight 397.493 g/mol
SMILES CCSC=1N(C(c2c(nc3c(c2)COC(C)(C)C3)N1)=O)c1ccc(cc1)OC
SPLASH splash10-00kk-0509000000-d7a4f204dd9c04551185
Synonyms Anthracen-4-one, 2-ethylsulfanyl-3-(4-methoxyphenyl)-7,7-dimethyl-3,5,7,8-tetrahydro-6-oxa-1,3,9-triaza- 2-Ethylsulfanyl-3-(4-methoxyphenyl)-8,8-dimethyl-6,9-dihydropyrano[3,4]pyrido[3,5-b]pyrimidin-4-one
Wiley ID 1457763