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5-Amino-2-methyl-7-(3-nitrophenyl)-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester
SpectraBase Compound ID LwAMNZaHjlm
InChI InChI=1S/C20H21N3O7S/c1-4-29-19(25)14-13(11-7-6-8-12(9-11)23(27)28)15(20(26)30-5-2)18-22(16(14)21)17(24)10(3)31-18/h6-10,13H,4-5,21H2,1-3H3
InChIKey ZTBSXRKQIXLYFX-UHFFFAOYSA-N
Mol Weight 447.46 g/mol
Molecular Formula C20H21N3O7S
Exact Mass 447.110021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIBN1LhGUoq
Name 5-Amino-2-methyl-7-(3-nitrophenyl)-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21N3O7S
InChI InChI=1S/C20H21N3O7S/c1-4-29-19(25)14-13(11-7-6-8-12(9-11)23(27)28)15(20(26)30-5-2)18-22(16(14)21)17(24)10(3)31-18/h6-10,13H,4-5,21H2,1-3H3
InChIKey ZTBSXRKQIXLYFX-UHFFFAOYSA-N
Molecular Weight 447.462 g/mol
SMILES NC=1N2C(=C(C(=O)OCC)C(C1C(=O)OCC)c1cc(N(=O)=O)ccc1)SC(C2=O)C
SPLASH splash10-004i-5439000000-71fbe0067c4fcc50d584
Synonyms 5-Amino-3-keto-2-methyl-7-(3-nitrophenyl)-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid diethyl ester Diethyl 5-amino-2-methyl-7-(3-nitrophenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl 5-amino-2-methyl-7-(3-nitrophenyl)-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl 5-amino-2-methyl-7-(3-nitrophenyl)-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate Diethyl 5-azanyl-2-methyl-7-(3-nitrophenyl)-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Wiley ID 1444798