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ethyl (2Z)-2-(1H-indol-3-ylmethylene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

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ethyl (2Z)-2-(1H-indol-3-ylmethylene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
SpectraBase Compound ID 7h1eKR2ZtIz
InChI InChI=1S/C25H21N3O3S/c1-3-31-24(30)21-15(2)27-25-28(22(21)16-9-5-4-6-10-16)23(29)20(32-25)13-17-14-26-19-12-8-7-11-18(17)19/h4-14,22,26H,3H2,1-2H3/b20-13-
InChIKey XQXZMRTZYFKKRF-MOSHPQCFSA-N
Mol Weight 443.52 g/mol
Molecular Formula C25H21N3O3S
Exact Mass 443.130363 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ip8QGFhQa6C
Name Ethyl (2Z)-2-(1H-indol-3-ylmethylene)-7-methyl-3-oxo-5-phenyl-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 443.130362719 u
Formula C25H21N3O3S
InChI InChI=1S/C25H21N3O3S/c1-3-31-24(30)21-15(2)27-25-28(22(21)16-9-5-4-6-10-16)23(29)20(32-25)13-17-14-26-19-12-8-7-11-18(17)19/h4-14,22,26H,3H2,1-2H3/b20-13-
InChIKey XQXZMRTZYFKKRF-MOSHPQCFSA-N
Molecular Weight 443.521 g/mol
SMILES N1C2=C(C(=C1)\C=C\1C(N3C(=NC(=C(C3C=3C=CC=CC3)C(=O)OCC)C)S1)=O)C=CC=C2