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Ethyl 5-[(1'-methyl-2'-{4-ethoxycarbonyl-5'-[(4-ethoxycarbonyl-1,2,3-thiadiazol-5-yl)sulfanyl]-1H-1,2,3-triazol-1-yl}-ethylamino]-1,2,3-thiadiazole-4-carboxylate

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Ethyl 5-[(1'-methyl-2'-{4-ethoxycarbonyl-5'-[(4-ethoxycarbonyl-1,2,3-thiadiazol-5-yl)sulfanyl]-1H-1,2,3-triazol-1-yl}-ethylamino]-1,2,3-thiadiazole-4-carboxylate
SpectraBase Compound ID 6mGbypmunXB
InChI InChI=1S/C18H22N8O6S3/c1-5-30-15(27)10-13(34-24-21-10)19-9(4)8-26-14(11(20-23-26)16(28)31-6-2)33-18-12(22-25-35-18)17(29)32-7-3/h9,19H,5-8H2,1-4H3
InChIKey RCAJFIXIKIPAJH-UHFFFAOYSA-N
Mol Weight 542.6 g/mol
Molecular Formula C18H22N8O6S3
Exact Mass 542.082444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3aXh4Z7iIy
Name Ethyl 5-[(1'-methyl-2'-{4-ethoxycarbonyl-5'-[(4-ethoxycarbonyl-1,2,3-thiadiazol-5-yl)sulfanyl]-1H-1,2,3-triazol-1-yl}-ethylamino]-1,2,3-thiadiazole-4-carboxylate
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Formula C18H22N8O6S3
InChI InChI=1S/C18H22N8O6S3/c1-5-30-15(27)10-13(34-24-21-10)19-9(4)8-26-14(11(20-23-26)16(28)31-6-2)33-18-12(22-25-35-18)17(29)32-7-3/h9,19H,5-8H2,1-4H3
InChIKey RCAJFIXIKIPAJH-UHFFFAOYSA-N
Molecular Weight 542.604 g/mol
SMILES N(c1c(nns1)C(=O)OCC)C(C[n]1c(c(nn1)C(=O)OCC)Sc1c(nns1)C(=O)OCC)C
SPLASH splash10-00kr-9684000000-8a084b742168cd397890
Source of Spectrum F5-1-4037-6
Synonyms Ethyl 5-((4-(ethoxycarbonyl)-1-(2-((4-(ethoxycarbonyl)-1,2,3-thiadiazol-5-yl)amino)propyl)-1H-1,2,3-triazol-5-yl)thio)-1,2,3-thiadiazole-4-carboxylate 5-[1-[4-ethoxycarbonyl-5-[(4-ethoxycarbonyl-5-thiadiazolyl)thio]-1-triazolyl]propan-2-ylamino]-4-thiadiazolecarboxylic acid ethyl ester Ethyl 5-[1-[4-ethoxycarbonyl-5-(4-ethoxycarbonylthiadiazol-5-yl)sulfanyltriazol-1-yl]propan-2-ylamino]thiadiazole-4-carboxylate Ethyl 5-[[2-[4-ethoxycarbonyl-5-(4-ethoxycarbonylthiadiazol-5-yl)sulfanyl-triazol-1-yl]-1-methyl-ethyl]amino]thiadiazole-4-carboxylate Ethyl 5-[1-[4-ethoxycarbonyl-5-[(4-ethoxycarbonyl-1,2,3-thiadiazol-5-yl)sulfanyl]-1,2,3-triazol-1-yl]propan-2-ylamino]-1,2,3-thiadiazole-4-carboxylate
Wiley ID 1731566