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Methyl ([3-cyano-4-(2-thienyl)-5,6,7,8-tetrahydro-2-quinolinyl]sulfanyl)acetate
SpectraBase Compound ID LI6gyncGDVA
InChI InChI=1S/C17H16N2O2S2/c1-21-15(20)10-23-17-12(9-18)16(14-7-4-8-22-14)11-5-2-3-6-13(11)19-17/h4,7-8H,2-3,5-6,10H2,1H3
InChIKey CGNLDABFXHAVLA-UHFFFAOYSA-N
Mol Weight 344.45 g/mol
Molecular Formula C17H16N2O2S2
Exact Mass 344.06532 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 38mMJcRUhGN
Name Methyl ([3-cyano-4-(2-thienyl)-5,6,7,8-tetrahydro-2-quinolinyl]sulfanyl)acetate
CAS Registry Number 210766-84-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O2S2
InChI InChI=1S/C17H16N2O2S2/c1-21-15(20)10-23-17-12(9-18)16(14-7-4-8-22-14)11-5-2-3-6-13(11)19-17/h4,7-8H,2-3,5-6,10H2,1H3
InChIKey CGNLDABFXHAVLA-UHFFFAOYSA-N
Molecular Weight 344.447 g/mol
SMILES c1(c(nc2c(c1-c1sccc1)CCCC2)SCC(=O)OC)C#N
SPLASH splash10-000f-6796000000-79c90868bf8f54136f70
Synonyms (3-Cyano-4-thiophen-2-yl-5,6,7,8-tetrahydro-quinolin-2-ylsulfanyl)-acetic acid methyl ester 2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)thio]acetic acid methyl ester 2-[[3-cyano-4-(2-thienyl)-5,6,7,8-tetrahydroquinolin-2-yl]thio]acetic acid methyl ester Methyl 2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetate Methyl 2-[(3-cyano-4-thiophen-2-yl-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]ethanoate Methyl 2-[[3-cyano-4-(2-thienyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]acetate
Wiley ID 1459727