Vitas-M small molecule compound
1-{6-hydroxy-3-methyl-2-oxo-7-[2-(pyrimidin-2-ylsulfanyl)ethyl]-3,7-dihydro-2H-purin-8-yl}piperidine-4-carboxamide
Catalog ID
STK562379
SMILES NC(=O)C1CCN(CC1)c1nc2c(n1CCSc1ncccn1)c(O)nc(=O)n2C
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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 C18H22N8O3S MW 430.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N8O3S/c1-24-14-12(15(28)23-18(24)29)26(9-10-30-16-20-5-2-6-21-16)17(22-14)25-7-3-11(4-8-25)13(19)27/h2,5-6,11H,3-4,7-10H2,1H3,(H2,19,27)(H,23,28,29)InChIKey
VJGWDFDTUGOACK-UHFFFAOYSA-NSynonyms
476482-88-91(3METHYL26DIOXO7(2PYRIMIDIN2YLSULFANYLETHYL)PURIN8YL)PIPERIDINE4CARBOXAMIDE
1(3METHYL26DIOXO7(2PYRIMIDIN2YLTHIOETHYL)137TRIHYDROPURIN8YL)PIPERIDINE4CARBOXAMIDE
1(6hydroxy3methyl2oxo7(2(pyrimidin2ylsulfanyl)ethyl)37dihydro2Hpurin8yl)piperidine4carboxamide
CN1C2=C(C(=O)NC1=O)N(C(=N2)N3CCC(CC3)C(=O)N)CCSC4=NC=CC=N4
Registry IDs
MFCD03801468ZINC000001774668
ZINC01774668
ZINC1774668
Check stock
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Check stock on Vitas-MAvailable files
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