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1-Acetyl-3-(4-chlorophenyl)-5-(4-chloro-2-morpholinothiazol-5-yl)-4,5-dihydro-1H-pyrazole

View entire compound with spectra: 1 MS (GC)

1-Acetyl-3-(4-chlorophenyl)-5-(4-chloro-2-morpholinothiazol-5-yl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID KQGVQgiYQ1M
InChI InChI=1S/C18H18Cl2N4O2S/c1-11(25)24-15(10-14(22-24)12-2-4-13(19)5-3-12)16-17(20)21-18(27-16)23-6-8-26-9-7-23/h2-5,15H,6-10H2,1H3
InChIKey XEMPTJRCNKFQSF-UHFFFAOYSA-N
Mol Weight 425.33 g/mol
Molecular Formula C18H18Cl2N4O2S
Exact Mass 424.052752 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEzJn4aLOLk
Name 1-Acetyl-3-(4-chlorophenyl)-5-(4-chloro-2-morpholinothiazol-5-yl)-4,5-dihydro-1H-pyrazole
Alternate Name(s) 1-(5-(4-chloro-2-morpholinothiazol-5-yl)-3-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-1-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18Cl2N4O2S
InChI InChI=1S/C18H18Cl2N4O2S/c1-11(25)24-15(10-14(22-24)12-2-4-13(19)5-3-12)16-17(20)21-18(27-16)23-6-8-26-9-7-23/h2-5,15H,6-10H2,1H3
InChIKey XEMPTJRCNKFQSF-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.201400084
Molecular Weight 425.334 g/mol
SMILES c1c(ccc(C=2CC(c3c(nc(s3)N3CCOCC3)Cl)N(C(=O)C)N2)c1)Cl
SPLASH splash10-0f89-6292200000-bc1647b7bf21c269a3b3
Source of Spectrum APC-347-572-7b
Wiley ID 1769588