Vitas-M small molecule compound
ethyl [1,7-dimethyl-2,4-dioxo-9-(2-phenylethyl)-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetate
Catalog ID
STL006545
SMILES CCOC(=O)Cn1c(=O)n(C)c2c(c1=O)n1CC(C)CN(c1n2)CCc1ccccc1
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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 C22H27N5O4 MW 425.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O4/c1-4-31-17(28)14-27-20(29)18-19(24(3)22(27)30)23-21-25(12-15(2)13-26(18)21)11-10-16-8-6-5-7-9-16/h5-9,15H,4,10-14H2,1-3H3InChIKey
XNVBCYJMGHGXNM-UHFFFAOYSA-NSynonyms
877801-45-1877801451
CCOC(=O)CN1C(=O)C2=C(N=C3N2CC(CN3CCC4=CC=CC=C4)C)N(C1=O)C
ethyl(17dimethyl24dioxo9(2phenylethyl)146789hexahydropyrimido(21f)purin3(2H)yl)acetate
ethyl2(17dimethyl24dioxo9(2phenylethyl)78dihydro6Hpurino(78a)pyrimidin3yl)acetate
ethyl2(17dimethyl24dioxo9phenethyl126789hexahydropyrimido(21f)purin3(4H)yl)acetate
ETHYL2(17DIMETHYL24DIOXO9PHENETHYL78DIHYDRO6HPURINO(78A)PYRIMIDIN3YL)ACETATE
InChI=1SC22H27N5O4c143117(28)142720(29)1819(24(3)22(27)30)232125(1215(2)1326(18)21)1110168657916h5915H41014H213H3
MFCD05704130
ZINC000005461389
ZINC000005461396
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