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ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

View entire compound with spectra: 2 NMR

ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 2GHuTcXplXN
InChI InChI=1S/C26H31N5O3S/c1-8-30-17(5)20(15(3)28-30)14-21-24(32)31-23(18-10-12-19(13-11-18)29(6)7)22(25(33)34-9-2)16(4)27-26(31)35-21/h10-14,23H,8-9H2,1-7H3/b21-14+
InChIKey YMFZCZGUBKJPEX-KGENOOAVSA-N
Mol Weight 493.63 g/mol
Molecular Formula C26H31N5O3S
Exact Mass 493.214761 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BnGAnTcLAXP
Name Ethyl (2E)-5-[4-(dimethylamino)phenyl]-2-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methylene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-A]pyrimidine-6-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 493.214761049 u
Formula C26H31N5O3S
InChI InChI=1S/C26H31N5O3S/c1-8-30-17(5)20(15(3)28-30)14-21-24(32)31-23(18-10-12-19(13-11-18)29(6)7)22(25(33)34-9-2)16(4)27-26(31)35-21/h10-14,23H,8-9H2,1-7H3/b21-14+
InChIKey YMFZCZGUBKJPEX-KGENOOAVSA-N
Molecular Weight 493.626 g/mol
SMILES CCOC(C=1C(N2C(=NC1C)S\C(C2=O)=C/C1=C(N(CC)N=C1C)C)C1=CC=C(C=C1)N(C)C)=O