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N-(4,6-dimethyl-2-pyrimidinyl)-2-phenyl-2-(phenylsulfanyl)acetamide
SpectraBase Compound ID 1sYSrPoCyBV
InChI InChI=1S/C20H19N3OS/c1-14-13-15(2)22-20(21-14)23-19(24)18(16-9-5-3-6-10-16)25-17-11-7-4-8-12-17/h3-13,18H,1-2H3,(H,21,22,23,24)
InChIKey ORQZRVIFAOJNAZ-UHFFFAOYSA-N
Mol Weight 349.45 g/mol
Molecular Formula C20H19N3OS
Exact Mass 349.124883 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KlZ44QIVk5R
Name N-(4,6-Dimethyl-2-pyrimidinyl)-2-phenyl-2-(phenylsulfanyl)acetamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.124883417 u
Formula C20H19N3OS
InChI InChI=1S/C20H19N3OS/c1-14-13-15(2)22-20(21-14)23-19(24)18(16-9-5-3-6-10-16)25-17-11-7-4-8-12-17/h3-13,18H,1-2H3,(H,21,22,23,24)
InChIKey ORQZRVIFAOJNAZ-UHFFFAOYSA-N
Molecular Weight 349.452 g/mol
SMILES N(C=1N=C(C=C(N1)C)C)C(C(SC1=CC=CC=C1)C=1C=CC=CC1)=O