Vitas-M small molecule compound
methyl 4-[1,3,6-trimethyl-7-(4-methylphenyl)-2,4-dioxo-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]butanoate
Catalog ID
STK687442
SMILES COC(=O)CCCn1c2nc3c(n2c(c1c1ccc(cc1)C)C)c(=O)n(c(=O)n3C)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 C22H25N5O4 MW 423.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N5O4/c1-13-8-10-15(11-9-13)17-14(2)27-18-19(24(3)22(30)25(4)20(18)29)23-21(27)26(17)12-6-7-16(28)31-5/h8-11H,6-7,12H2,1-5H3InChIKey
OMYFTRGCINBYHX-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)C2=C(N3C4=C(N=C3N2CCCC(=O)OC)N(C(=O)N(C4=O)C)C)C
InChI=1SC22H25N5O4c11381015(11913)1714(2)271819(24(3)22(30)25(4)20(18)29)2321(27)26(17)126716(28)315h811H6712H215H3
methyl4(136trimethyl7(4methylphenyl)24dioxo1234tetrahydro8Himidazo(21f)purin8yl)butanoate
METHYL4(248TRIMETHYL7(4METHYLPHENYL)13DIOXOPURINO(78A)IMIDAZOL6YL)BUTANOATE
MFCD06618825
ZINC000004626121
ZINC04626121
ZINC4626121
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