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1-Acetyl-5-(4-chloro-2-morpholinothiazol-5-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID Erdjrm4cten
InChI InChI=1S/C19H21ClN4O2S/c1-12-3-5-14(6-4-12)15-11-16(24(22-15)13(2)25)17-18(20)21-19(27-17)23-7-9-26-10-8-23/h3-6,16H,7-11H2,1-2H3
InChIKey GPCNKNCYXGCPAM-UHFFFAOYSA-N
Mol Weight 404.92 g/mol
Molecular Formula C19H21ClN4O2S
Exact Mass 404.107375 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AkA6jRQ69qi
Name 1-Acetyl-5-(4-chloro-2-morpholinothiazol-5-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21ClN4O2S
InChI InChI=1S/C19H21ClN4O2S/c1-12-3-5-14(6-4-12)15-11-16(24(22-15)13(2)25)17-18(20)21-19(27-17)23-7-9-26-10-8-23/h3-6,16H,7-11H2,1-2H3
InChIKey GPCNKNCYXGCPAM-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201400084
Molecular Weight 404.916 g/mol
SMILES c1c(ccc(C=2CC(c3c(nc(s3)N3CCOCC3)Cl)N(C(=O)C)N2)c1)C
SPLASH splash10-053r-9551100000-a93cc68950511f525a85
Source of Spectrum APC-347-572-7d
Synonyms 1-(5-(4-chloro-2-morpholinothiazol-5-yl)-3-(p-tolyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone
Wiley ID 1769590