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7-(1-azepanyl)-5-methyl-3-phenyl-2-thiazolo[4,5-d]pyrimidinethione
SpectraBase Compound ID 1psV9SaiTcM
InChI InChI=1S/C18H20N4S2/c1-13-19-16(21-11-7-2-3-8-12-21)15-17(20-13)22(18(23)24-15)14-9-5-4-6-10-14/h4-6,9-10H,2-3,7-8,11-12H2,1H3
InChIKey JGWISONBMYBWAS-UHFFFAOYSA-N
Mol Weight 356.51 g/mol
Molecular Formula C18H20N4S2
Exact Mass 356.112939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2rBhYPmlrFj
Name 7-(1-azepanyl)-5-methyl-3-phenyl-2-thiazolo[4,5-d]pyrimidinethione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N4S2
InChI InChI=1S/C18H20N4S2/c1-13-19-16(21-11-7-2-3-8-12-21)15-17(20-13)22(18(23)24-15)14-9-5-4-6-10-14/h4-6,9-10H,2-3,7-8,11-12H2,1H3
InChIKey JGWISONBMYBWAS-UHFFFAOYSA-N
Molecular Weight 356.506 g/mol
SMILES c12c(c(nc(n2)C)N2CCCCCC2)SC(N1c1ccccc1)=S
SPLASH splash10-0006-9100000000-6c1059e2db4a9ab5e1ea
Synonyms 7-(azepan-1-yl)-5-methyl-3-phenyl-thiazolo[4,5-d]pyrimidine-2-thione 7-(azepan-1-yl)-5-methyl-3-phenyl-[1,3]thiazolo[4,5-d]pyrimidine-2-thione
Wiley ID 1444696