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(Z)-5,9-Dimethyl-7-phenyl-2-(4-trifluromethylbenzyliden)-5,6-dihydropyrazolo[3,4-f]thiazolo[2,3-b][1,3,5]tri-azepin-3-one

View entire compound with spectra: 1 MS (GC)

(Z)-5,9-Dimethyl-7-phenyl-2-(4-trifluromethylbenzyliden)-5,6-dihydropyrazolo[3,4-f]thiazolo[2,3-b][1,3,5]tri-azepin-3-one
SpectraBase Compound ID 8utw5nNygen
InChI InChI=1S/C23H18F3N5OS/c1-13-19-20(31(29-13)17-6-4-3-5-7-17)27-14(2)30-21(32)18(33-22(30)28-19)12-15-8-10-16(11-9-15)23(24,25)26/h3-12,14,27H,1-2H3/b18-12-
InChIKey LIJKCXLQIPSBOO-PDGQHHTCSA-N
Mol Weight 469.49 g/mol
Molecular Formula C23H18F3N5OS
Exact Mass 469.118416 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMFQPKWCvTs
Name (Z)-5,9-Dimethyl-7-phenyl-2-(4-trifluromethylbenzyliden)-5,6-dihydropyrazolo[3,4-f]thiazolo[2,3-b][1,3,5]tri-azepin-3-one
Alternate Name(s) 3,8-Dimethyl-1-phenyl-6-[1-(4-trifluoromethyl-phenyl)-meth-(Z)-ylidene]-8,9-dihydro-1H-5-thia-1,2,4,7a,9-pentaaza-cyclopenta[f]azulen-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18F3N5OS
InChI InChI=1S/C23H18F3N5OS/c1-13-19-20(31(29-13)17-6-4-3-5-7-17)27-14(2)30-21(32)18(33-22(30)28-19)12-15-8-10-16(11-9-15)23(24,25)26/h3-12,14,27H,1-2H3/b18-12-
InChIKey LIJKCXLQIPSBOO-PDGQHHTCSA-N
Molecular Weight 469.486 g/mol
SMILES N1C(N2C(\C(SC2=Nc2c1[n](nc2C)-c1ccccc1)=C\c1ccc(C(F)(F)F)cc1)=O)C
SPLASH splash10-014i-0110900000-8aa63d52031ff8ede4a9
Source of Spectrum Y-46-760-6f
Wiley ID 1666771