7-Allyl-8-[(4-amino-6-morpholino-1,3,5-triazin-2-yl)methylsulfanyl]-1,3-dimethyl-purine-2,6-dione

SpectraBase Compound ID	GGHeEmg8OVO
InChI	InChI=1S/C18H23N9O3S/c1-4-5-27-12-13(24(2)18(29)25(3)14(12)28)22-17(27)31-10-11-20-15(19)23-16(21-11)26-6-8-30-9-7-26/h4H,1,5-10H2,2-3H3,(H2,19,20,21,23)
InChIKey	YBKOPBFYDARGBZ-UHFFFAOYSA-N Google Search
Mol Weight	445.5 g/mol
Molecular Formula	C18H23N9O3S
Exact Mass	445.164457 g/mol

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SpectraBase Spectrum ID	C0KrtNkRK7g
Name	7-Allyl-8-[(4-amino-6-morpholino-1,3,5-triazin-2-yl)methylsulfanyl]-1,3-dimethyl-purine-2,6-dione
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C18H23N9O3S
InChI	InChI=1S/C18H23N9O3S/c1-4-5-27-12-13(24(2)18(29)25(3)14(12)28)22-17(27)31-10-11-20-15(19)23-16(21-11)26-6-8-30-9-7-26/h4H,1,5-10H2,2-3H3,(H2,19,20,21,23)
InChIKey	YBKOPBFYDARGBZ-UHFFFAOYSA-N
Molecular Weight	445.502 g/mol
SMILES	Nc1nc(nc(n1)CSc1nc2c(C(=O)N(C(N2C)=O)C)[n]1CC=C)N1CCOCC1
SPLASH	splash10-0005-7910000000-2bd1861c35bb4104e929
Synonyms	7-Allyl-8-[(4-amino-6-morpholino-s-triazin-2-yl)methylthio]-1,3-dimethyl-xanthine 8-[(4-amino-6-morpholin-4-yl-1,3,5-triazin-2-yl)methylsulfanyl]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione 8-[(4-azanyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)methylsulfanyl]-1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione 8-[[4-amino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]methylthio]-1,3-dimethyl-7-prop-2-enylpurine-2,6-dione
Wiley ID	1460391