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N-(5-acetyl-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)-2-chloro-5-(methylsulfanyl)benzamide
SpectraBase Compound ID 1EUUzC71Bmz
InChI InChI=1S/C24H21ClN2O2S/c1-15(28)27-22-6-4-3-5-16(22)7-8-17-9-10-18(13-23(17)27)26-24(29)20-14-19(30-2)11-12-21(20)25/h3-6,9-14H,7-8H2,1-2H3,(H,26,29)
InChIKey DSZOUHIRZSBDTA-UHFFFAOYSA-N
Mol Weight 436.96 g/mol
Molecular Formula C24H21ClN2O2S
Exact Mass 436.101227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4CB3ki4KIvW
Name N-(5-acetyl-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)-2-chloro-5-(methylsulfanyl)benzamide
Alternate Name(s) 2-Chloranyl-N-(11-ethanoyl-5,6-dihydrobenzo[b][1]benzazepin-2-yl)-5-methylsulfanyl-benzamide N-(11-acetyl-5,6-dihydrobenzo[b][1]benzazepin-2-yl)-2-chloro-5-(methylthio)benzamide N-(11-acetyl-5,6-dihydrobenzo[b][1]benzazepin-2-yl)-2-chloro-5-methylsulfanyl-benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21ClN2O2S
InChI InChI=1S/C24H21ClN2O2S/c1-15(28)27-22-6-4-3-5-16(22)7-8-17-9-10-18(13-23(17)27)26-24(29)20-14-19(30-2)11-12-21(20)25/h3-6,9-14H,7-8H2,1-2H3,(H,26,29)
InChIKey DSZOUHIRZSBDTA-UHFFFAOYSA-N
Molecular Weight 436.957 g/mol
SMILES N(C(c1c(ccc(c1)SC)Cl)=O)c1cc2N(c3c(CCc2cc1)cccc3)C(=O)C
SPLASH splash10-0006-7912000000-c479677267b79909b26a
Wiley ID 1462113