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acetamide, N-[4-[(5E)-5-[[4-(acetyloxy)-2-chloro-5-methoxyphenyl]methylene]-2-imino-4-oxothiazolidinyl]-1,2,5-oxadiazol-3-yl]-

View entire compound with spectra: 1 NMR, and 1 MS (GC)

acetamide, N-[4-[(5E)-5-[[4-(acetyloxy)-2-chloro-5-methoxyphenyl]methylene]-2-imino-4-oxothiazolidinyl]-1,2,5-oxadiazol-3-yl]-
SpectraBase Compound ID 5IrJjCqvviW
InChI InChI=1S/C17H14ClN5O6S/c1-7(24)20-14-15(22-29-21-14)23-16(26)13(30-17(23)19)5-9-4-11(27-3)12(6-10(9)18)28-8(2)25/h4-6,19H,1-3H3,(H,20,21,24)/b13-5+,19-17?
InChIKey PSYFQZDSOHMIHD-SRNIEEMRSA-N
Mol Weight 451.84 g/mol
Molecular Formula C17H14ClN5O6S
Exact Mass 451.035332 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44M22S6blCQ
Name 4-({3-[4-(acetylamino)-1,2,5-oxadiazol-3-yl]-2-imino-4-oxo-1,3-thiazolidin-5-ylidene}methyl)-5-chloro-2-methoxyphenyl acetate
Alternate Name(s) 4-((E)-{3-[4-(acetylamino)-1,2,5-oxadiazol-3-yl]-2-imino-4-oxo-1,3-thiazolidin-5-ylidene}methyl)-5-chloro-2-methoxyphenyl acetate Acetic acid 4-[3-(4-acetylamino-furazan-3-yl)-2-imino-4-oxo-thiazolidin-5-ylidenemethyl]-5-chloro-2-methoxy-phenyl ester Acetic acid[4-[(E)-[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-5-thiazolidinylidene]methyl]-5-chloro-2-methoxyphenyl]ester Acetic acid[4-[(E)-[3-(4-acetamidofurazan-3-yl)-2-imino-4-keto-thiazolidin-5-ylidene]methyl]-5-chloro-2-methoxy-phenyl]ester [4-[(E)-[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-azanylidene-4-oxidanylidene-1,3-thiazolidin-5-ylidene]methyl]-5-chloranyl-2-methoxy-phenyl]ethanoate [4-[(E)-[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl]-5-chloro-2-methoxyphenyl]acetate [4-[(E)-[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-thiazolidin-5-ylidene]methyl]-5-chloro-2-methoxy-phenyl]acetate Acetic acid [4-[(E)-[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-5-thiazolidinylidene]methyl]-5-chloro-2-methoxyphenyl] ester [4-[(E)-[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-1,3-thiazolidin-5-ylidene]methyl]-5-chloro-2-methoxyphenyl] acetate [4-[(E)-[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-imino-4-oxo-thiazolidin-5-ylidene]methyl]-5-chloro-2-methoxy-phenyl] acetate [4-[(E)-[3-(4-acetamido-1,2,5-oxadiazol-3-yl)-2-azanylidene-4-oxidanylidene-1,3-thiazolidin-5-ylidene]methyl]-5-chloranyl-2-methoxy-phenyl] ethanoate
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Formula C17H14ClN5O6S
InChI InChI=1S/C17H14ClN5O6S/c1-7(24)20-14-15(22-29-21-14)23-16(26)13(30-17(23)19)5-9-4-11(27-3)12(6-10(9)18)28-8(2)25/h4-6,19H,1-3H3,(H,20,21,24)/b13-5+,19-17?
InChIKey PSYFQZDSOHMIHD-SRNIEEMRSA-N
Molecular Weight 451.841 g/mol
SMILES N(c1c(N2C(S\C(C2=O)=C/c2c(cc(c(c2)OC)OC(=O)C)Cl)=N)non1)C(=O)C
SPLASH splash10-0006-9572000000-4a8e929af3172f328fea
Wiley ID 1462706