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7-keto-2-[[2-(phenylthio)acetyl]amino]-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester
SpectraBase Compound ID 2gTTp85Ojn3
InChI InChI=1S/C19H19NO4S2/c1-2-24-19(23)16-13-9-6-10-14(21)17(13)26-18(16)20-15(22)11-25-12-7-4-3-5-8-12/h3-5,7-8H,2,6,9-11H2,1H3,(H,20,22)
InChIKey CXDDLBQTIALQTD-UHFFFAOYSA-N
Mol Weight 389.48 g/mol
Molecular Formula C19H19NO4S2
Exact Mass 389.07555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K9clxMZ0WCF
Name 7-keto-2-[[2-(phenylthio)acetyl]amino]-5,6-dihydro-4H-benzothiophene-3-carboxylic acid ethyl ester
Alternate Name(s) 7-Oxo-2-[[1-oxo-2-(phenylthio)ethyl]amino]-5,6-dihydro-4H-1-benzothiophene-3-carboxylic acid ethyl ester Ethyl 7-oxidanylidene-2-(2-phenylsulfanylethanoylamino)-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Ethyl 7-oxo-2-[(2-phenylsulfanylacetyl)amino]-5,6-dihydro-4H-1-benzothiophene-3-carboxylate Ethyl 7-oxo-2-[(2-phenylsulfanylacetyl)amino]-5,6-dihydro-4H-benzothiophene-3-carboxylate Ethyl 7-oxo-2-{[(phenylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
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Formula C19H19NO4S2
InChI InChI=1S/C19H19NO4S2/c1-2-24-19(23)16-13-9-6-10-14(21)17(13)26-18(16)20-15(22)11-25-12-7-4-3-5-8-12/h3-5,7-8H,2,6,9-11H2,1H3,(H,20,22)
InChIKey CXDDLBQTIALQTD-UHFFFAOYSA-N
Molecular Weight 389.484 g/mol
SMILES N(c1c(c2CCCC(c2s1)=O)C(=O)OCC)C(=O)CSc1ccccc1
SPLASH splash10-000b-9310000000-a673fae38e68b0259db0
Wiley ID 1470265