Vitas-M small molecule compound
methyl [8-(4-butylphenyl)-1-methyl-2,4-dioxo-1,2,4,6,7,8-hexahydro-3H-imidazo[2,1-f]purin-3-yl]acetate
Catalog ID
STK575026
SMILES CCCCc1ccc(cc1)N1CCn2c1nc1c2c(=O)n(c(=O)n1C)CC(=O)OC
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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 C21H25N5O4 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O4/c1-4-5-6-14-7-9-15(10-8-14)24-11-12-25-17-18(22-20(24)25)23(2)21(29)26(19(17)28)13-16(27)30-3/h7-10H,4-6,11-13H2,1-3H3InChIKey
KLGDQCBSXOZQTN-UHFFFAOYSA-NSynonyms
893959-38-1893959381
CCCCC1=CC=C(C=C1)N2CCN3C2=NC4=C3C(=O)N(C(=O)N4C)CC(=O)OC
InChI=1SC21H25N5O4c1456147915(10814)241112251718(2220(24)25)23(2)21(29)26(19(17)28)1316(27)303h710H461113H213H3
methyl(8(4butylphenyl)1methyl24dioxo124678hexahydro3Himidazo(21f)purin3yl)acetate
METHYL2(6(4BUTYLPHENYL)4METHYL13DIOXO78DIHYDROPURINO(78A)IMIDAZOL2YL)ACETATE
methyl2(8(4butylphenyl)1methyl24dioxo78dihydro1Himidazo(21f)purin3(2H4H6H)yl)acetate
MFCD06611810
ZINC000012532159
ZINC12532159
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