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1H-isoindole-2-hexanamide, N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thien-2-yl)-2,3-dihydro-1,3-dioxo-
SpectraBase Compound ID DNYd6TK49aV
InChI InChI=1S/C22H21N3O3S/c23-13-17-14-9-6-10-18(14)29-20(17)24-19(26)11-2-1-5-12-25-21(27)15-7-3-4-8-16(15)22(25)28/h3-4,7-8H,1-2,5-6,9-12H2,(H,24,26)
InChIKey OTMMWCGRQMSOLI-UHFFFAOYSA-N
Mol Weight 407.49 g/mol
Molecular Formula C22H21N3O3S
Exact Mass 407.130363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GwfqHuBTlH
Name 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)hexanamide
Alternate Name(s) N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-6-(1,3-dioxo-2-isoindolyl)hexanamide N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-6-(1,3-dioxoisoindol-2-yl)hexanamide N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-6-(1,3-dioxoisoindolin-2-yl)hexanamide N-(3-cyano-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl)-6-phthalimido-hexanamide
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Formula C22H21N3O3S
InChI InChI=1S/C22H21N3O3S/c23-13-17-14-9-6-10-18(14)29-20(17)24-19(26)11-2-1-5-12-25-21(27)15-7-3-4-8-16(15)22(25)28/h3-4,7-8H,1-2,5-6,9-12H2,(H,24,26)
InChIKey OTMMWCGRQMSOLI-UHFFFAOYSA-N
Molecular Weight 407.488 g/mol
SMILES N(c1c(c2CCCc2s1)C#N)C(=O)CCCCCN1C(c2ccccc2C1=O)=O
SPLASH splash10-03di-0900000000-26a9cfdc30e907d529d4
Wiley ID 1464185