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Ethanethioic acid, S-[3-2-(3-ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)-3(2H)-benzothiazolyl]propyl] ester
SpectraBase Compound ID m3Yt59PAaZ
InChI InChI=1S/C17H18N2O2S4/c1-3-18-15(21)14(25-17(18)22)16-19(9-6-10-23-11(2)20)12-7-4-5-8-13(12)24-16/h4-5,7-8H,3,6,9-10H2,1-2H3/b16-14+
InChIKey LHIUVCZOZJGHOQ-JQIJEIRASA-N
Mol Weight 410.6 g/mol
Molecular Formula C17H18N2O2S4
Exact Mass 410.025113 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23soRZtSrD1
Name Ethanethioic acid, S-[3-2-(3-ethyl-4-oxo-2-thioxo-5-thiazolidinylidene)-3(2H)-benzothiazolyl]propyl] ester
Alternate Name(s) S-(3-(2-(3-ethyl-4-oxo-2-thioxothiazolidin-5-ylidene)benzo[d]thiazol-3(2H)-yl)propyl) ethanethioate Ethanethioic acid S-[3-[2-(3-ethyl-4-oxo-2-sulfanylidene-5-thiazolidinylidene)-1,3-benzothiazol-3-yl]propyl] ester S-[3-[2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]propyl] ethanethioate S-[3-[2-(3-ethyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]propyl] ethanethioate S-[3-[2-(3-ethyl-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-1,3-benzothiazol-3-yl]propyl] ethanethioate
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Formula C17H18N2O2S4
InChI InChI=1S/C17H18N2O2S4/c1-3-18-15(21)14(25-17(18)22)16-19(9-6-10-23-11(2)20)12-7-4-5-8-13(12)24-16/h4-5,7-8H,3,6,9-10H2,1-2H3/b16-14+
InChIKey LHIUVCZOZJGHOQ-JQIJEIRASA-N
Molecular Weight 410.583 g/mol
SMILES CCN1C(=S)S\C(C1=O)=C/1Sc2ccccc2N1CCCSC(C)=O
SPLASH splash10-0udi-2591300000-931b8461b15acccd402b
Source of Spectrum JX-2015-4-157
Wiley ID 1725607