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1H-Pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 4,8-dihydro-3-hydroxy-4-phenyl-1-(tetrahydro-2,2-dimethyl-2H-pyran-4-yl)-
SpectraBase Compound ID Cy1p71g5khv
InChI InChI=1S/C19H23N3O3S/c1-19(2)10-13(8-9-25-19)22-17-15(18(24)21-22)16(26-11-14(23)20-17)12-6-4-3-5-7-12/h3-7,13,16H,8-11H2,1-2H3,(H,20,23)(H,21,24)
InChIKey XZMYEIIKMSLVAL-UHFFFAOYSA-N
Mol Weight 373.47 g/mol
Molecular Formula C19H23N3O3S
Exact Mass 373.146013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5768fdpmDQ6
Name 1H-Pyrazolo[3,4-e][1,4]thiazepin-7(6H)-one, 4,8-dihydro-3-hydroxy-4-phenyl-1-(tetrahydro-2,2-dimethyl-2H-pyran-4-yl)-
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Formula C19H23N3O3S
InChI InChI=1S/C19H23N3O3S/c1-19(2)10-13(8-9-25-19)22-17-15(18(24)21-22)16(26-11-14(23)20-17)12-6-4-3-5-7-12/h3-7,13,16H,8-11H2,1-2H3,(H,20,23)(H,21,24)
InChIKey XZMYEIIKMSLVAL-UHFFFAOYSA-N
Molecular Weight 373.471 g/mol
SMILES N1C(CSC(c2c1[n](nc2O)C1CC(OCC1)(C)C)c1ccccc1)=O
SPLASH splash10-0a4j-8961000000-5776719f01c9a159ab8c
Source of Spectrum IY-1-4581-7
Synonyms 1-(2,2-dimethyl-4-oxanyl)-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione 1-(2,2-dimethyltetrahydropyran-4-yl)-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione 1-(2,2-dimethyloxan-4-yl)-4-phenyl-4,8-dihydro-2H-pyrazolo[3,4-e][1,4]thiazepine-3,7-dione
Wiley ID 1653800