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Ethyl 2-(2-cyano-3-(4-(piperidin-1-yl)phenyl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
SpectraBase Compound ID Ewa3iFqALPx
InChI InChI=1S/C26H29N3O3S/c1-2-32-26(31)23-21-8-4-5-9-22(21)33-25(23)28-24(30)19(17-27)16-18-10-12-20(13-11-18)29-14-6-3-7-15-29/h10-13,16H,2-9,14-15H2,1H3,(H,28,30)/b19-16+
InChIKey OTPSGEUZYRWRJV-KNTRCKAVSA-N
Mol Weight 463.6 g/mol
Molecular Formula C26H29N3O3S
Exact Mass 463.192963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2TNEPZuvvy9
Name Ethyl 2-(2-cyano-3-(4-(piperidin-1-yl)phenyl)acrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
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Formula C26H29N3O3S
InChI InChI=1S/C26H29N3O3S/c1-2-32-26(31)23-21-8-4-5-9-22(21)33-25(23)28-24(30)19(17-27)16-18-10-12-20(13-11-18)29-14-6-3-7-15-29/h10-13,16H,2-9,14-15H2,1H3,(H,28,30)/b19-16+
InChIKey OTPSGEUZYRWRJV-KNTRCKAVSA-N
Molecular Weight 463.596 g/mol
SMILES N(c1c(c2CCCCc2s1)C(=O)OCC)C(\C(=C\c1ccc(N2CCCCC2)cc1)C#N)=O
SPLASH splash10-00xr-4922300000-d65a1b07754226581e8c
Source of Spectrum Y-48-1284-7b
Synonyms 2-[[(E)-2-cyano-1-oxo-3-[4-(1-piperidinyl)phenyl]prop-2-enyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester Ethyl 2-[[(E)-2-cyano-3-[4-(1-piperidyl)phenyl]prop-2-enoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Ethyl 2-[[(E)-2-cyano-3-(4-piperidin-1-ylphenyl)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Wiley ID 1704448