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2-(diethylamino)-5-methyl-3-phenyl-6-tosyl-4(3H)-pyrimidinon
SpectraBase Compound ID LmdcI4sFYXe
InChI InChI=1S/C22H25N3O3S/c1-5-24(6-2)22-23-20(29(27,28)19-14-12-16(3)13-15-19)17(4)21(26)25(22)18-10-8-7-9-11-18/h7-15H,5-6H2,1-4H3
InChIKey BEPVJQYFGLTMIJ-UHFFFAOYSA-N
Mol Weight 411.52 g/mol
Molecular Formula C22H25N3O3S
Exact Mass 411.161663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LH4d1qkjTY1
Name 2-(diethylamino)-5-methyl-3-phenyl-6-tosyl-4(3H)-pyrimidinon
Alternate Name(s) 2-(diethylamino)-5-methyl-6-[(4-methylphenyl)sulfonyl]-3-phenyl-4(3H)-pyrimidinone
CAS Registry Number 100083-19-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25N3O3S
InChI InChI=1S/C22H25N3O3S/c1-5-24(6-2)22-23-20(29(27,28)19-14-12-16(3)13-15-19)17(4)21(26)25(22)18-10-8-7-9-11-18/h7-15H,5-6H2,1-4H3
InChIKey BEPVJQYFGLTMIJ-UHFFFAOYSA-N
Molecular Weight 411.520 g/mol
SMILES C=1(N=C(N(CC)CC)N(C(C1C)=O)c1ccccc1)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-004i-4902000000-8cba6c24f6b13a73699e
Source of Spectrum K-119-1451-4
Wiley ID 1374086