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1H-Isoindole-2-acetamide, 5-chloro-N-(3-cyano-4,7-dihydro-5,5-dimethyl-5H-thieno[2,3-c]pyran-2-yl)-2,3,3a,4,7,7a-hexahydro-1,3-dioxo-
SpectraBase Compound ID 4ZqqTgILdWr
InChI InChI=1S/C20H20ClN3O4S/c1-20(2)6-13-14(7-22)17(29-15(13)9-28-20)23-16(25)8-24-18(26)11-4-3-10(21)5-12(11)19(24)27/h3,11-12H,4-6,8-9H2,1-2H3,(H,23,25)
InChIKey JQPIOQYTTALCMG-UHFFFAOYSA-N
Mol Weight 433.91 g/mol
Molecular Formula C20H20ClN3O4S
Exact Mass 433.086305 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GmSKACn5vKv
Name 1H-Isoindole-2-acetamide, 5-chloro-N-(3-cyano-4,7-dihydro-5,5-dimethyl-5H-thieno[2,3-c]pyran-2-yl)-2,3,3a,4,7,7a-hexahydro-1,3-dioxo-
Alternate Name(s) 2-(5-Chloro-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)-N-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)acetamide 2-[5-chloranyl-1,3-bis(oxidanylidene)-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(3-cyano-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-2-yl)ethanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClN3O4S
InChI InChI=1S/C20H20ClN3O4S/c1-20(2)6-13-14(7-22)17(29-15(13)9-28-20)23-16(25)8-24-18(26)11-4-3-10(21)5-12(11)19(24)27/h3,11-12H,4-6,8-9H2,1-2H3,(H,23,25)
InChIKey JQPIOQYTTALCMG-UHFFFAOYSA-N
Molecular Weight 433.910 g/mol
SMILES N(c1c(c2CC(C)(C)OCc2s1)C#N)C(CN1C(C2CC(Cl)=CCC2C1=O)=O)=O
SPLASH splash10-0a4l-9400000000-545af11f389031c6ea92
Source of Spectrum IY-1-4607-4
Wiley ID 1654057