Vitas-M small molecule compound
1-(1,1-dioxidotetrahydrothiophen-3-yl)-7,9-dimethyl-3-phenyl-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Catalog ID
STK783683
SMILES Cn1c(=O)n(C)c2c(c1=O)n1CC(=NN(c1n2)C1CCS(=O)(=O)C1)c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C19H20N6O4S MW 428.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20N6O4S/c1-22-16-15(17(26)23(2)19(22)27)24-10-14(12-6-4-3-5-7-12)21-25(18(24)20-16)13-8-9-30(28,29)11-13/h3-7,13H,8-11H2,1-2H3InChIKey
XIXWUHQJAKQVRE-UHFFFAOYSA-NSynonyms
1(11dioxidotetrahydrothiophen3yl)79dimethyl3phenyl14dihydro(124)triazino(34f)purine68(7H9H)dione
1(11DIOXOTHIOLAN3YL)79DIMETHYL3PHENYL4HPURINO(87C)(124)TRIAZINE68DIONE
CN1C2=C(C(=O)N(C1=O)C)N3CC(=NN(C3=N2)C4CCS(=O)(=O)C4)C5=CC=CC=C5
InChI=1SC19H20N6O4Sc1221615(17(26)23(2)19(22)27)241014(126435712)2125(18(24)2016)138930(2829)1113h3713H811H212H3
MFCD06618835
ZINC000012427913
ZINC000012427914
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