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Ethyl 2-[2'-(4"-methyl-1"-piperidinyl)thiocarbamoyl]phenylthio]acylamino]-thiazol-4-acetate
SpectraBase Compound ID 49hQPZ9Is7z
InChI InChI=1S/C22H27N3O3S3/c1-3-28-18(26)13-17-14-30-21(23-17)24-20(27)19(16-7-5-4-6-8-16)31-22(29)25-11-9-15(2)10-12-25/h4-8,14-15,19H,3,9-13H2,1-2H3,(H,23,24,27)
InChIKey JPIQLGRDNNUBPF-UHFFFAOYSA-N
Mol Weight 477.66 g/mol
Molecular Formula C22H27N3O3S3
Exact Mass 477.121455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eSN8mn4w0a
Name Ethyl 2-[2'-(4"-methyl-1"-piperidinyl)thiocarbamoyl]phenylthio]acylamino]-thiazol-4-acetate
Alternate Name(s) Ethyl 2-(2-(2-(4-methylpiperidine-1-carbonothioylthio)-2-phenylacetamido)thiazol-4-yl)acetate 2-[2-[[2-[[(4-methyl-1-piperidinyl)-sulfanylidenemethyl]thio]-1-oxo-2-phenylethyl]amino]-4-thiazolyl]acetic acid ethyl ester Ethyl 2-[2-[[2-(4-methylpiperidine-1-carbothioyl)sulfanyl-2-phenylacetyl]amino]-1,3-thiazol-4-yl]acetate Ethyl 2-[2-[[2-(4-methylpiperidine-1-carbothioyl)sulfanyl-2-phenyl-acetyl]amino]thiazol-4-yl]acetate Ethyl 2-(2-(2-((4-methylpiperidine-1-carbonothioyl)thio)-2-phenylacetamido)thiazol-4-yl)acetate Ethyl 2-[2-[[2-(4-methylpiperidin-1-yl)carbothioylsulfanyl-2-phenyl-ethanoyl]amino]-1,3-thiazol-4-yl]ethanoate
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Formula C22H27N3O3S3
InChI InChI=1S/C22H27N3O3S3/c1-3-28-18(26)13-17-14-30-21(23-17)24-20(27)19(16-7-5-4-6-8-16)31-22(29)25-11-9-15(2)10-12-25/h4-8,14-15,19H,3,9-13H2,1-2H3,(H,23,24,27)
InChIKey JPIQLGRDNNUBPF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.200390002
Molecular Weight 477.656 g/mol
SMILES N(c1scc(n1)CC(OCC)=O)C(C(SC(N1CCC(CC1)C)=S)c1ccccc1)=O
SPLASH splash10-000f-4946000000-7ad4a2da5b559b555231
Source of Spectrum APP-336-45-3u
Wiley ID 1770664