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3-(5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-2-(4-oxo-4,5-dihydro-thiazol-2-yl)-acrylic acid ethyl ester
SpectraBase Compound ID 3HeVk1cxYTx
InChI InChI=1S/C18H16ClN3O3S/c1-3-25-18(24)14(17-20-15(23)10-26-17)9-13-11(2)21-22(16(13)19)12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3/b14-9-
InChIKey JYWLCOQCEAFMDW-ZROIWOOFSA-N
Mol Weight 389.86 g/mol
Molecular Formula C18H16ClN3O3S
Exact Mass 389.06009 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DNfGyyYeumB
Name 3-(5-Chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-2-(4-oxo-4,5-dihydro-thiazol-2-yl)-acrylic acid ethyl ester
Alternate Name(s) Ethyl (2E)-3-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-2-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)-2-propenoate Ethyl 3-(5-chloro-3-methyl-1-phenyl-1H-pyrazol-4-yl)-2-(4-oxo-4,5-dihydro-1,3-thiazol-2-yl)-2-propenoate
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Formula C18H16ClN3O3S
InChI InChI=1S/C18H16ClN3O3S/c1-3-25-18(24)14(17-20-15(23)10-26-17)9-13-11(2)21-22(16(13)19)12-7-5-4-6-8-12/h4-9H,3,10H2,1-2H3/b14-9-
InChIKey JYWLCOQCEAFMDW-ZROIWOOFSA-N
Molecular Weight 389.857 g/mol
SMILES C1SC(=NC1=O)\C(=C\c1c(Cl)[n](nc1C)-c1ccccc1)C(OCC)=O
SPLASH splash10-0a6r-9422000000-c68753dd53f9532cd069
Wiley ID 1453650