Vitas-M small molecule compound
7-(3-chloro-4-ethoxyphenyl)-8-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-dimethyl-1H-imidazo[2,1-f]purine-2,4(3H,8H)-dione
Catalog ID
STK979648
SMILES CCOc1ccc(cc1Cl)c1cn2c(n1c1ccc3c(c1)OCCO3)nc1c2c(=O)n(C)c(=O)n1C
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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 C25H22ClN5O5 MW 507.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN5O5/c1-4-34-18-7-5-14(11-16(18)26)17-13-30-21-22(28(2)25(33)29(3)23(21)32)27-24(30)31(17)15-6-8-19-20(12-15)36-10-9-35-19/h5-8,11-13H,4,9-10H2,1-3H3InChIKey
GHQNUDMKQBFZBK-UHFFFAOYSA-NSynonyms
848871-12-57(3CHLORO4ETHOXYPHENYL)6(23DIHYDRO14BENZODIOXIN6YL)24DIMETHYLPURINO(78A)IMIDAZOLE13DIONE
7(3chloro4ethoxyphenyl)8(23dihydro14benzodioxin6yl)13dimethyl1Himidazo(21f)purine24(3H8H)dione
7(3chloro4ethoxyphenyl)8(23dihydrobenzo(b)(14)dioxin6yl)13dimethyl1Himidazo(21f)purine24(3H8H)dione
848871125
CCOC1=C(C=C(C=C1)C2=CN3C4=C(N=C3N2C5=CC6=C(C=C5)OCCO6)N(C(=O)N(C4=O)C)C)Cl
InChI=1SC25H22ClN5O5c1434187514(1116(18)26)1713302122(28(2)25(33)29(3)23(21)32)2724(30)31(17)15681920(1215)361093519h581113H4910H213H3
MFCD04197753
ZINC000009109598
ZINC09109598
ZINC9109598
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