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ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-[(1-phenylethyl)amino]-5-pyrimidinecarboxylate

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ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-[(1-phenylethyl)amino]-5-pyrimidinecarboxylate
SpectraBase Compound ID AHGzVFjtTt1
InChI InChI=1S/C20H23N5O2/c1-5-27-19(26)17-12-21-20(25-14(3)11-13(2)24-25)23-18(17)22-15(4)16-9-7-6-8-10-16/h6-12,15H,5H2,1-4H3,(H,21,22,23)
InChIKey YYXJFGVZHAYZCA-UHFFFAOYSA-N
Mol Weight 365.44 g/mol
Molecular Formula C20H23N5O2
Exact Mass 365.185175 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FDM7CziVgkI
Name Ethyl 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-[(1-phenylethyl)amino]-5-pyrimidinecarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 365.185174999 u
Formula C20H23N5O2
InChI InChI=1S/C20H23N5O2/c1-5-27-19(26)17-12-21-20(25-14(3)11-13(2)24-25)23-18(17)22-15(4)16-9-7-6-8-10-16/h6-12,15H,5H2,1-4H3,(H,21,22,23)
InChIKey YYXJFGVZHAYZCA-UHFFFAOYSA-N
Molecular Weight 365.437 g/mol
SMILES N(C=1N=C(N2N=C(C)C=C2C)N=CC1C(=O)OCC)C(C=1C=CC=CC1)C