Vitas-M small molecule compound
ethyl 4-{[1,3-dimethyl-2,6-dioxo-7-(2-oxo-2-phenylethyl)-2,3,6,7-tetrahydro-1H-purin-8-yl]methyl}piperazine-1-carboxylate
Catalog ID
STK848135
SMILES CCOC(=O)N1CCN(CC1)Cc1nc2c(n1CC(=O)c1ccccc1)c(=O)n(c(=O)n2C)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 C23H28N6O5 MW 468.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N6O5/c1-4-34-23(33)28-12-10-27(11-13-28)15-18-24-20-19(21(31)26(3)22(32)25(20)2)29(18)14-17(30)16-8-6-5-7-9-16/h5-9H,4,10-15H2,1-3H3InChIKey
JHTQBYRHNFOGFA-UHFFFAOYSA-NSynonyms
851940-69-7851940697
CCOC(=O)N1CCN(CC1)CC2=NC3=C(N2CC(=O)C4=CC=CC=C4)C(=O)N(C(=O)N3C)C
ETHYL4((13DIMETHYL26DIOXO7(2OXO2PHENYLETHYL)137TRIHYDROPURIN8YL)METHYL)PIPERAZINECARBOXYLATE
ethyl4((13dimethyl26dioxo7(2oxo2phenylethyl)2367tetrahydro1Hpurin8yl)methyl)piperazine1carboxylate
ETHYL4((13DIMETHYL26DIOXO7PHENACYLPURIN8YL)METHYL)PIPERAZINE1CARBOXYLATE
InChI=1SC23H28N6O5c143423(33)28121027(111328)1518242019(21(31)26(3)22(32)25(20)2)29(18)1417(30)168657916h59H41015H213H3
MFCD04466547
ZINC000020519607
ZINC20519607
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