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Ethyl 2-(2-cyano-3-(dimethylamino)acrylamido)-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylate
SpectraBase Compound ID KkTggJjGaFw
InChI InChI=1S/C17H21N3O3S/c1-4-23-17(22)14-12-7-5-6-8-13(12)24-16(14)19-15(21)11(9-18)10-20(2)3/h10H,4-8H2,1-3H3,(H,19,21)/b11-10+
InChIKey JFLOOCPAOPFKQU-ZHACJKMWSA-N
Mol Weight 347.43 g/mol
Molecular Formula C17H21N3O3S
Exact Mass 347.130363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZBgrBca0uH
Name Ethyl 2-(2-cyano-3-(dimethylamino)acrylamido)-4,5,6,7-tetrahydro-benzo[b]thiophene-3-carboxylate
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Formula C17H21N3O3S
InChI InChI=1S/C17H21N3O3S/c1-4-23-17(22)14-12-7-5-6-8-13(12)24-16(14)19-15(21)11(9-18)10-20(2)3/h10H,4-8H2,1-3H3,(H,19,21)/b11-10+
InChIKey JFLOOCPAOPFKQU-ZHACJKMWSA-N
Molecular Weight 347.433 g/mol
SMILES N(c1c(c2CCCCc2s1)C(=O)OCC)C(\C(=C\N(C)C)C#N)=O
SPLASH splash10-00di-1900000000-1869caaccb90bdd67f43
Source of Spectrum Y-48-1284-12
Synonyms 2-[[(E)-2-cyano-3-(dimethylamino)-1-oxoprop-2-enyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester Ethyl 2-[[(E)-2-cyano-3-(dimethylamino)prop-2-enoyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Ethyl 2-[[(E)-2-cyano-3-(dimethylamino)prop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Wiley ID 1704446