Vitas-M small molecule compound
3-(4-chlorobenzyl)-9-(4-ethoxyphenyl)-1,7-dimethyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
Catalog ID
STL002471
SMILES CCOc1ccc(cc1)N1CC(C)Cn2c1nc1c2c(=O)n(c(=O)n1C)Cc1ccc(cc1)Cl
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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 C25H26ClN5O3 MW 479.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26ClN5O3/c1-4-34-20-11-9-19(10-12-20)29-13-16(2)14-30-21-22(27-24(29)30)28(3)25(33)31(23(21)32)15-17-5-7-18(26)8-6-17/h5-12,16H,4,13-15H2,1-3H3InChIKey
RNNNRFZEFLOTLN-UHFFFAOYSA-NSynonyms
844459-03-63((4CHLOROPHENYL)METHYL)9(4ETHOXYPHENYL)17DIMETHYL135TRIHYDRO6H7H8H13DIAZAPERHYDROINO(12H)PURINE24DIONE
3((4CHLOROPHENYL)METHYL)9(4ETHOXYPHENYL)17DIMETHYL78DIHYDRO6HPURINO(78A)PYRIMIDINE24DIONE
3(4chlorobenzyl)9(4ethoxyphenyl)17dimethyl6789tetrahydropyrimido(21f)purine24(1H3H)dione
844459036
CCOC1=CC=C(C=C1)N2CC(CN3C2=NC4=C3C(=O)N(C(=O)N4C)CC5=CC=C(C=C5)Cl)C
InChI=1SC25H26ClN5O3c14342011919(101220)291316(2)14302122(2724(29)30)28(3)25(33)31(23(21)32)15175718(26)8617h51216H41315H213H3
MFCD04156913
ZINC000009088925
ZINC000009088926
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