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(Z)-ethyl 2-(2-cyano-2-(5-oxo-3-phenylthiazolidin-2-ylidene)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
SpectraBase Compound ID FCtD6FIcGcj
InChI InChI=1S/C23H21N3O4S2/c1-2-30-23(29)19-15-10-6-7-11-17(15)31-21(19)25-20(28)16(12-24)22-26(13-18(27)32-22)14-8-4-3-5-9-14/h3-5,8-9H,2,6-7,10-11,13H2,1H3,(H,25,28)/b22-16-
InChIKey WYVSGUQNKJDPAB-JWGURIENSA-N
Mol Weight 467.56 g/mol
Molecular Formula C23H21N3O4S2
Exact Mass 467.097349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hk6WEoYeb7T
Name (Z)-ethyl 2-(2-cyano-2-(5-oxo-3-phenylthiazolidin-2-ylidene)acetamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
Alternate Name(s) 2-[[(2Z)-2-cyano-1-oxo-2-(5-oxo-3-phenyl-2-thiazolidinylidene)ethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester Ethyl 2-[[(2Z)-2-cyano-2-(5-oxo-3-phenyl-1,3-thiazolidin-2-ylidene)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Ethyl 2-[[(2Z)-2-cyano-2-(5-oxo-3-phenyl-thiazolidin-2-ylidene)acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Ethyl 2-[[(2Z)-2-cyano-2-(5-oxidanylidene-3-phenyl-1,3-thiazolidin-2-ylidene)ethanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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Formula C23H21N3O4S2
InChI InChI=1S/C23H21N3O4S2/c1-2-30-23(29)19-15-10-6-7-11-17(15)31-21(19)25-20(28)16(12-24)22-26(13-18(27)32-22)14-8-4-3-5-9-14/h3-5,8-9H,2,6-7,10-11,13H2,1H3,(H,25,28)/b22-16-
InChIKey WYVSGUQNKJDPAB-JWGURIENSA-N
Literature Reference DOI 10.1002/ardp.201000165
Molecular Weight 467.558 g/mol
SMILES N(c1sc2CCCCc2c1C(OCC)=O)C(\C(=C/1SC(CN1c1ccccc1)=O)C#N)=O
SPLASH splash10-00or-8490400000-66ee021f12dbc2acb287
Source of Spectrum APC-344-175-4
Wiley ID 1769211