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N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]acetamide
SpectraBase Compound ID oVFC6T4F5B
InChI InChI=1S/C19H21N5O2S/c1-12-10-13(2)21-19(20-12)27-11-16(25)22-17-14(3)23(4)24(18(17)26)15-8-6-5-7-9-15/h5-10H,11H2,1-4H3,(H,22,25)
InChIKey OTFASMKXSOBTAA-UHFFFAOYSA-N
Mol Weight 383.47 g/mol
Molecular Formula C19H21N5O2S
Exact Mass 383.141596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AU1qGsZhabA
Name 2-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide
Alternate Name(s) N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanamide N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetamide N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-acetamide
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Formula C19H21N5O2S
InChI InChI=1S/C19H21N5O2S/c1-12-10-13(2)21-19(20-12)27-11-16(25)22-17-14(3)23(4)24(18(17)26)15-8-6-5-7-9-15/h5-10H,11H2,1-4H3,(H,22,25)
InChIKey OTFASMKXSOBTAA-UHFFFAOYSA-N
Molecular Weight 383.470 g/mol
SMILES N(C=1C(N(c2ccccc2)N(C1C)C)=O)C(=O)CSc1nc(C)cc(n1)C
SPLASH splash10-0pc0-9420000000-2d1304dad231d11a6a97
Wiley ID 1446745