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N-Benzyl-N1((8-methyl-4-phenyl-2H-benzopyran-2-one-7-yloxy)acetyl)-thiosemicarbazide
SpectraBase Compound ID JWhqgefFU2H
InChI InChI=1S/C26H23N3O4S/c1-17-22(32-16-23(30)28-29-26(34)27-15-18-8-4-2-5-9-18)13-12-20-21(14-24(31)33-25(17)20)19-10-6-3-7-11-19/h2-14H,15-16H2,1H3,(H,28,30)(H2,27,29,34)
InChIKey SGLCSENXYYCXBD-UHFFFAOYSA-N
Mol Weight 473.55 g/mol
Molecular Formula C26H23N3O4S
Exact Mass 473.140927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AlrvmIYlgs3
Name N-Benzyl-N1((8-methyl-4-phenyl-2H-benzopyran-2-one-7-yloxy)acetyl)-thiosemicarbazide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H23N3O4S
InChI InChI=1S/C26H23N3O4S/c1-17-22(32-16-23(30)28-29-26(34)27-15-18-8-4-2-5-9-18)13-12-20-21(14-24(31)33-25(17)20)19-10-6-3-7-11-19/h2-14H,15-16H2,1H3,(H,28,30)(H2,27,29,34)
InChIKey SGLCSENXYYCXBD-UHFFFAOYSA-N
Molecular Weight 473.547 g/mol
SMILES N(NC(=S)NCc1ccccc1)C(COc1c(c2c(C(c3ccccc3)=CC(O2)=O)cc1)C)=O
SPLASH splash10-00di-0000900000-ea898be74b9366d4cc3a
Source of Spectrum F2-45-3956-5a
Synonyms 1-[[2-[(8-methyl-2-oxo-4-phenyl-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-3-(phenylmethyl)thiourea 1-benzyl-3-[[2-(8-methyl-2-oxo-4-phenylchromen-7-yl)oxyacetyl]amino]thiourea 1-benzyl-3-[[2-(8-methyl-2-oxo-4-phenyl-chromen-7-yl)oxyacetyl]amino]thiourea 1-[2-(8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxyethanoylamino]-3-(phenylmethyl)thiourea
Wiley ID 1689396