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4-[3-[3-(4-methylphenyl)-3-oxidanylidene-1-thiophen-2-yl-propyl]pyrrolo[2,3-b]pyridin-1-yl]butan-2-one
SpectraBase Compound ID 8f3QeFOrYjr
InChI InChI=1S/C25H24N2O2S/c1-17-7-9-19(10-8-17)23(29)15-21(24-6-4-14-30-24)22-16-27(13-11-18(2)28)25-20(22)5-3-12-26-25/h3-10,12,14,16,21H,11,13,15H2,1-2H3
InChIKey ANZBYPPJNQKYDN-UHFFFAOYSA-N
Mol Weight 416.54 g/mol
Molecular Formula C25H24N2O2S
Exact Mass 416.155849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IPXdB9f0Elb
Name 4-[3-[3-(4-methylphenyl)-3-oxidanylidene-1-thiophen-2-yl-propyl]pyrrolo[2,3-b]pyridin-1-yl]butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H24N2O2S
InChI InChI=1S/C25H24N2O2S/c1-17-7-9-19(10-8-17)23(29)15-21(24-6-4-14-30-24)22-16-27(13-11-18(2)28)25-20(22)5-3-12-26-25/h3-10,12,14,16,21H,11,13,15H2,1-2H3
InChIKey ANZBYPPJNQKYDN-UHFFFAOYSA-N
Molecular Weight 416.539 g/mol
SMILES CC(CC[n]1c2c(cccn2)c(c1)C(CC(c1ccc(cc1)C)=O)c1cccs1)=O
SPLASH splash10-00ls-0090200000-cc83f0f4fd92a90be65b
Source of Spectrum K1-0-2400-5
Synonyms 4-[3-[3-(4-methylphenyl)-3-oxo-1-thiophen-2-ylpropyl]-1-pyrrolo[2,3-b]pyridinyl]-2-butanone 4-[3-[3-(4-methylphenyl)-3-oxo-1-thiophen-2-ylpropyl]pyrrolo[2,3-b]pyridin-1-yl]butan-2-one 4-[3-[3-keto-3-(p-tolyl)-1-(2-thienyl)propyl]pyrrolo[2,3-b]pyridin-1-yl]butan-2-one 4-[3-[3-oxo-3-(p-tolyl)-1-(2-thienyl)propyl]pyrrolo[2,3-b]pyridin-1-yl]butan-2-one
Wiley ID 1588904