Vitas-M small molecule compound
9-benzyl-3-(2,5-dimethylbenzyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL005592
SMILES Cc1ccc(c(c1)Cn1c(=O)n(C)c2c(c1=O)n1CCCN(c1n2)Cc1ccccc1)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 C25H27N5O2 MW 429.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O2/c1-17-10-11-18(2)20(14-17)16-30-23(31)21-22(27(3)25(30)32)26-24-28(12-7-13-29(21)24)15-19-8-5-4-6-9-19/h4-6,8-11,14H,7,12-13,15-16H2,1-3H3InChIKey
RALUTNKSIKFEMX-UHFFFAOYSA-NSynonyms
850242-48-7850242487
9BENZYL3((25DIMETHYLPHENYL)METHYL)1METHYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
9benzyl3(25dimethylbenzyl)1methyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
CC1=CC(=C(C=C1)C)CN2C(=O)C3=C(N=C4N3CCCN4CC5=CC=CC=C5)N(C2=O)C
InChI=1SC25H27N5O2c117101118(2)20(1417)163023(31)2122(27(3)25(30)32)262428(1271329(21)24)15198546919h4681114H712131516H213H3
MFCD05692021
ZINC000009308872
ZINC09308872
ZINC9308872
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