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1H-pyrazole-4-carboxylic acid, 5-[[[7-(chlorodifluoromethyl)-5-(2-thienyl)pyrazolo[1,5-a]pyrimidin-2-yl]carbonyl]amino]-1-phenyl-, ethyl ester
SpectraBase Compound ID 6hzWR7DoinN
InChI InChI=1S/C24H17ClF2N6O3S/c1-2-36-23(35)15-13-28-32(14-7-4-3-5-8-14)21(15)30-22(34)17-12-20-29-16(18-9-6-10-37-18)11-19(24(25,26)27)33(20)31-17/h3-13H,2H2,1H3,(H,30,34)
InChIKey HJSKVKWPSZJROK-UHFFFAOYSA-N
Mol Weight 542.95 g/mol
Molecular Formula C24H17ClF2N6O3S
Exact Mass 542.073944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGEMdqSpoxa
Name 5-[[7-[chloro(difluoro)methyl]-5-(2-thienyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester
Alternate Name(s) 5-[[[7-[chloro(difluoro)methyl]-5-thiophen-2-yl-2-pyrazolo[1,5-a]pyrimidinyl]-oxomethyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester Ethyl 5-[[7-[chloranyl-bis(fluoranyl)methyl]-5-thiophen-2-yl-pyrazolo[1,5-a]pyrimidin-2-yl]carbonylamino]-1-phenyl-pyrazole-4-carboxylate Ethyl 5-[[7-[chloro(difluoro)methyl]-5-(2-thienyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]-1-phenyl-pyrazole-4-carboxylate Ethyl 5-[[7-[chloro(difluoro)methyl]-5-thiophen-2-ylpyrazolo[1,5-a]pyrimidine-2-carbonyl]amino]-1-phenylpyrazole-4-carboxylate
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Formula C24H17ClF2N6O3S
InChI InChI=1S/C24H17ClF2N6O3S/c1-2-36-23(35)15-13-28-32(14-7-4-3-5-8-14)21(15)30-22(34)17-12-20-29-16(18-9-6-10-37-18)11-19(24(25,26)27)33(20)31-17/h3-13H,2H2,1H3,(H,30,34)
InChIKey HJSKVKWPSZJROK-UHFFFAOYSA-N
Molecular Weight 542.949 g/mol
SMILES N(c1c(cn[n]1-c1ccccc1)C(=O)OCC)C(c1n[n]2C(=CC(=Nc2c1)c1sccc1)C(Cl)(F)F)=O
SPLASH splash10-03di-9525000000-4ecca90ca1895c099d89
Wiley ID 1453919