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Tert-Butyl N-[2-(4-methoxyphenyl)-8-methyl-6-methylene-1-oxo-3-thioxo-1,2,3,5,7-hexahydroimidazo[1,5-a]pyrazin-7-yl]carbamate

View entire compound with spectra: 1 MS (GC)

Tert-Butyl N-[2-(4-methoxyphenyl)-8-methyl-6-methylene-1-oxo-3-thioxo-1,2,3,5,7-hexahydroimidazo[1,5-a]pyrazin-7-yl]carbamate
SpectraBase Compound ID IkNz7XjGSWi
InChI InChI=1S/C20H24N4O4S/c1-12-11-22-16(13(2)24(12)21-18(26)28-20(3,4)5)17(25)23(19(22)29)14-7-9-15(27-6)10-8-14/h7-10H,1,11H2,2-6H3,(H,21,26)
InChIKey KTBCZHMFFZHSBI-UHFFFAOYSA-N
Mol Weight 416.5 g/mol
Molecular Formula C20H24N4O4S
Exact Mass 416.151826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fk4IR6NjKUP
Name Tert-Butyl N-[2-(4-methoxyphenyl)-8-methyl-6-methylene-1-oxo-3-thioxo-1,2,3,5,7-hexahydroimidazo[1,5-a]pyrazin-7-yl]carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24N4O4S
InChI InChI=1S/C20H24N4O4S/c1-12-11-22-16(13(2)24(12)21-18(26)28-20(3,4)5)17(25)23(19(22)29)14-7-9-15(27-6)10-8-14/h7-10H,1,11H2,2-6H3,(H,21,26)
InChIKey KTBCZHMFFZHSBI-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c4ob00676c
Molecular Weight 416.496 g/mol
SMILES N(N1C(CN2C(=C1C)C(=O)N(c1ccc(cc1)OC)C2=S)=C)C(=O)OC(C)(C)C
SPLASH splash10-03fr-0900000000-429359338df42efec951
Source of Spectrum F5-12-4615-5ad
Synonyms tert-Butyl (2-(4-methoxyphenyl)-8-methyl-6-methylene-1-oxo-3-thioxo-2,3,5,6-tetrahydroimidazo[1,5-a]pyrazin-7(1H)-yl)carbamate
Wiley ID 1747557