Vitas-M small molecule compound
1-(2-hydroxyethyl)-7,9-dimethyl-3-(4-methylphenyl)-1,4-dihydro[1,2,4]triazino[3,4-f]purine-6,8(7H,9H)-dione
Catalog ID
STK784091
SMILES OCCN1N=C(Cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1ccc(cc1)C
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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 C18H20N6O3 MW 368.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N6O3/c1-11-4-6-12(7-5-11)13-10-23-14-15(19-17(23)24(20-13)8-9-25)21(2)18(27)22(3)16(14)26/h4-7,25H,8-10H2,1-3H3InChIKey
QSAVXDSFDIEPNK-UHFFFAOYSA-NSynonyms
1(2hydroxyethyl)79dimethyl3(4methylphenyl)14dihydro(124)triazino(34f)purine68(7H9H)dione
1(2HYDROXYETHYL)79DIMETHYL3(4METHYLPHENYL)4HPURINO(87C)(124)TRIAZINE68DIONE
CC1=CC=C(C=C1)C2=NN(C3=NC4=C(N3C2)C(=O)N(C(=O)N4C)C)CCO
InChI=1SC18H20N6O3c1114612(7511)1310231415(1917(23)24(2013)8925)21(2)18(27)22(3)16(14)26h4725H810H213H3
MFCD06619431
ZINC000004626219
ZINC04626219
ZINC4626219
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