Vitas-M small molecule compound
butyl 4-[1,3-dimethyl-2,4-dioxo-7-(thiophen-2-yl)-1,2,3,4-tetrahydro-8H-imidazo[2,1-f]purin-8-yl]benzoate
Catalog ID
STK693553
SMILES CCCCOC(=O)c1ccc(cc1)n1c(cn2c1nc1c2c(=O)n(c(=O)n1C)C)c1cccs1
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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 C24H23N5O4S MW 477.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N5O4S/c1-4-5-12-33-22(31)15-8-10-16(11-9-15)29-17(18-7-6-13-34-18)14-28-19-20(25-23(28)29)26(2)24(32)27(3)21(19)30/h6-11,13-14H,4-5,12H2,1-3H3InChIKey
MXCSKMARZCZZSZ-UHFFFAOYSA-NSynonyms
butyl4(13dimethyl24dioxo7(thiophen2yl)1234tetrahydro8Himidazo(21f)purin8yl)benzoate
butyl4(24dimethyl13dioxo7thiophen2ylpurino(78a)imidazol6yl)benzoate
CCCCOC(=O)C1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C5=CC=CS5
InChI=1SC24H23N5O4Sc145123322(31)1581016(11915)2917(1876133418)14281920(2523(28)29)26(2)24(32)27(3)21(19)30h6111314H4512H213H3
MFCD12033622
ZINC000015107160
ZINC15107160
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