Vitas-M small molecule compound
1-{7-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}piperidine-4-carboxamide
Catalog ID
STK590418
SMILES NC(=O)C1CCN(CC1)c1nc2c(n1CCSc1nc3c([nH]1)cccc3)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 C22H26N8O3S MW 482.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N8O3S/c1-27-18-16(19(32)28(2)22(27)33)30(21(26-18)29-9-7-13(8-10-29)17(23)31)11-12-34-20-24-14-5-3-4-6-15(14)25-20/h3-6,13H,7-12H2,1-2H3,(H2,23,31)(H,24,25)InChIKey
JHGSMJRFHAIRPI-UHFFFAOYSA-NSynonyms
476482-51-61(7(2((1Hbenzo(d)imidazol2yl)thio)ethyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)piperidine4carboxamide
1(7(2(1Hbenzimidazol2ylsulfanyl)ethyl)13dimethyl26dioxo2367tetrahydro1Hpurin8yl)piperidine4carboxamide
1(7(2(1HBENZIMIDAZOL2YLSULFANYL)ETHYL)13DIMETHYL26DIOXOPURIN8YL)PIPERIDINE4CARBOXAMIDE
1(7(2BENZIMIDAZOL2YLTHIOETHYL)13DIMETHYL26DIOXO137TRIHYDROPURIN8YL)PIPERIDINE4CARBOXAMIDE
476482516
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCC(CC3)C(=O)N)CCSC4=NC5=CC=CC=C5N4
InChI=1SC22H26N8O3Sc1271816(19(32)28(2)22(27)33)30(21(2618)299713(81029)17(23)31)111234202414534615(14)2520h3613H712H212H3(H22331)(H2425)
MFCD03933822
NC(=O)C1CCN(CC1)c1nc2c(n1CCSc1nc3c((nH)1)cccc3)c(=O)n(c(=O)n2C)C
ZINC000008642847
ZINC08642847
ZINC8642847
Check stock
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Check stock on Vitas-MAvailable files
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