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Benzoic acid, 2-[[2-[4-oxo-3-[(tetrahydro-2-furanyl)methyl]-2-thioxo-5-thiazolidinyl]acetyl]amino]-, ethyl ester
SpectraBase Compound ID Y5HAL6vIRt
InChI InChI=1S/C19H22N2O5S2/c1-2-25-18(24)13-7-3-4-8-14(13)20-16(22)10-15-17(23)21(19(27)28-15)11-12-6-5-9-26-12/h3-4,7-8,12,15H,2,5-6,9-11H2,1H3,(H,20,22)
InChIKey UREXJWUWWUOUPI-UHFFFAOYSA-N
Mol Weight 422.51 g/mol
Molecular Formula C19H22N2O5S2
Exact Mass 422.097014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JzyhfGPO3GL
Name Benzoic acid, 2-[[2-[4-oxo-3-[(tetrahydro-2-furanyl)methyl]-2-thioxo-5-thiazolidinyl]acetyl]amino]-, ethyl ester
Alternate Name(s) Ethyl 2-{2-[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-yl]acetamido}benzoate 2-[[1-oxo-2-[4-oxo-3-(2-oxolanylmethyl)-2-sulfanylidene-5-thiazolidinyl]ethyl]amino]benzoic acid ethyl ester Ethyl 2-[[2-[4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-yl]acetyl]amino]benzoate Ethyl 2-[[2-[4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-thiazolidin-5-yl]acetyl]amino]benzoate Ethyl 2-[2-[4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1,3-thiazolidin-5-yl]ethanoylamino]benzoate
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Formula C19H22N2O5S2
InChI InChI=1S/C19H22N2O5S2/c1-2-25-18(24)13-7-3-4-8-14(13)20-16(22)10-15-17(23)21(19(27)28-15)11-12-6-5-9-26-12/h3-4,7-8,12,15H,2,5-6,9-11H2,1H3,(H,20,22)
InChIKey UREXJWUWWUOUPI-UHFFFAOYSA-N
Molecular Weight 422.514 g/mol
SMILES N(c1c(C(=O)OCC)cccc1)C(CC1C(N(C(S1)=S)CC1OCCC1)=O)=O
SPLASH splash10-00lr-9620000000-33158a51d419adb28837
Source of Spectrum IY-2-5074-7
Wiley ID 1658730