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5-Amino-7-(4-chlorophenyl)-2-methyl-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid O6-butyl ester O8-ethyl ester
SpectraBase Compound ID BZtUuPVvZS1
InChI InChI=1S/C22H25ClN2O5S/c1-4-6-11-30-21(27)16-15(13-7-9-14(23)10-8-13)17(22(28)29-5-2)20-25(18(16)24)19(26)12(3)31-20/h7-10,12,15H,4-6,11,24H2,1-3H3
InChIKey DREVKQGQUUGQSU-UHFFFAOYSA-N
Mol Weight 464.96 g/mol
Molecular Formula C22H25ClN2O5S
Exact Mass 464.117271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JpGN07Mex5f
Name 5-Amino-7-(4-chlorophenyl)-2-methyl-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid O6-butyl ester O8-ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25ClN2O5S
InChI InChI=1S/C22H25ClN2O5S/c1-4-6-11-30-21(27)16-15(13-7-9-14(23)10-8-13)17(22(28)29-5-2)20-25(18(16)24)19(26)12(3)31-20/h7-10,12,15H,4-6,11,24H2,1-3H3
InChIKey DREVKQGQUUGQSU-UHFFFAOYSA-N
Molecular Weight 464.964 g/mol
SMILES NC=1N2C(=C(C(=O)OCC)C(C1C(=O)OCCCC)c1ccc(cc1)Cl)SC(C2=O)C
SPLASH splash10-0udl-9314000000-623829d89d38f7864ce3
Synonyms 5-Amino-7-(4-chlorophenyl)-3-keto-2-methyl-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid O6-butyl ester O8-ethyl ester 6-Butyl 8-ethyl 5-amino-7-(4-chlorophenyl)-2-methyl-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate 6-O-butyl 8-O-ethyl 5-amino-7-(4-chlorophenyl)-2-methyl-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate O6-butyl O8-ethyl 5-amino-7-(4-chlorophenyl)-2-methyl-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylate O6-butyl O8-ethyl 5-azanyl-7-(4-chlorophenyl)-2-methyl-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate
Wiley ID 1445824