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2-[2-[(1,3-dimethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]phenoxy]-N-phenylacetamide
SpectraBase Compound ID IPvjnCdlvwZ
InChI InChI=1S/C21H19N3O4S/c1-23-19(26)16(20(27)24(2)21(23)29)12-14-8-6-7-11-17(14)28-13-18(25)22-15-9-4-3-5-10-15/h3-12H,13H2,1-2H3,(H,22,25)
InChIKey SPYFOVQVZBLQJB-UHFFFAOYSA-N
Mol Weight 409.46 g/mol
Molecular Formula C21H19N3O4S
Exact Mass 409.109627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4Kwad6B72aU
Name 2-[2-[(1,3-dimethyl-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]phenoxy]-N-phenylacetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O4S
InChI InChI=1S/C21H19N3O4S/c1-23-19(26)16(20(27)24(2)21(23)29)12-14-8-6-7-11-17(14)28-13-18(25)22-15-9-4-3-5-10-15/h3-12H,13H2,1-2H3,(H,22,25)
InChIKey SPYFOVQVZBLQJB-UHFFFAOYSA-N
Molecular Weight 409.460 g/mol
SMILES N(C(=O)COc1c(cccc1)C=C1C(N(C(N(C1=O)C)=S)C)=O)c1ccccc1
SPLASH splash10-0a4i-8950000000-bdcba38a0565c606ed6a
Synonyms 2-[2-[(1,3-dimethyl-4,6-dioxo-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]phenoxy]-N-phenyl-acetamide 2-[2-[(4,6-diketo-1,3-dimethyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]phenoxy]-N-phenyl-acetamide 2-[2-[[1,3-dimethyl-4,6-bis(oxidanylidene)-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]phenoxy]-N-phenyl-ethanamide
Wiley ID 1444401