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[1-(2-methylphenyl)-4-(methylsulfanyl)-6-phenyl-2-thioxo-1,2-dihydro-3-pyridinyl](phenyl)methanone
SpectraBase Compound ID T0KIHcaykk
InChI InChI=1S/C26H21NOS2/c1-18-11-9-10-16-21(18)27-22(19-12-5-3-6-13-19)17-23(30-2)24(26(27)29)25(28)20-14-7-4-8-15-20/h3-17H,1-2H3
InChIKey FUKAFLKFQTUZKA-UHFFFAOYSA-N
Mol Weight 427.58 g/mol
Molecular Formula C26H21NOS2
Exact Mass 427.106457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BiVsI34Pe1
Name [1-(2-methylphenyl)-4-(methylsulfanyl)-6-phenyl-2-thioxo-1,2-dihydro-3-pyridinyl](phenyl)methanone
CAS Registry Number 120105-36-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H21NOS2
InChI InChI=1S/C26H21NOS2/c1-18-11-9-10-16-21(18)27-22(19-12-5-3-6-13-19)17-23(30-2)24(26(27)29)25(28)20-14-7-4-8-15-20/h3-17H,1-2H3
InChIKey FUKAFLKFQTUZKA-UHFFFAOYSA-N
Molecular Weight 427.580 g/mol
SMILES C1(N(C(=CC(=C1C(=O)c1ccccc1)SC)c1ccccc1)c1c(C)cccc1)=S
SPLASH splash10-00fs-7109400000-766569ddf2b56072f987
Source of Spectrum Y-25-1132-6
Synonyms [1-(2-methylphenyl)-4-(methylthio)-6-phenyl-2-sulfanylidene-3-pyridinyl]-phenylmethanone [1-(2-methylphenyl)-4-methylsulfanyl-6-phenyl-2-sulfanylidene-pyridin-3-yl]-phenyl-methanone [4-(methylthio)-1-(o-tolyl)-6-phenyl-2-thioxo-3-pyridyl]-phenyl-methanone [4-methylsulfanyl-1-(o-tolyl)-6-phenyl-2-thioxo-3-pyridyl]-phenyl-methanone
Wiley ID 1380439