Vitas-M small molecule compound
3-(4-chlorobenzyl)-7-hydroxy-1-methyl-9-phenyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL345371
SMILES OC1CN(c2ccccc2)c2n(C1)c1c(=O)n(Cc3ccc(cc3)Cl)c(=O)n(c1n2)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 C22H20ClN5O3 MW 437.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5O3/c1-25-19-18(20(30)28(22(25)31)11-14-7-9-15(23)10-8-14)27-13-17(29)12-26(21(27)24-19)16-5-3-2-4-6-16/h2-10,17,29H,11-13H2,1H3InChIKey
PTTZZGNHEIVGRG-UHFFFAOYSA-NSynonyms
848063-94-53((4CHLOROPHENYL)METHYL)7HYDROXY1METHYL9PHENYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
3(4chlorobenzyl)7hydroxy1methyl9phenyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
848063945
CN1C2=C(C(=O)N(C1=O)CC3=CC=C(C=C3)Cl)N4CC(CN(C4=N2)C5=CC=CC=C5)O
InChI=1SC22H20ClN5O3c1251918(20(30)28(22(25)31)11147915(23)10814)271317(29)1226(21(27)2419)165324616h2101729H1113H21H3
MFCD04187370
ZINC000009009927
ZINC000009009928
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