Vitas-M small molecule compound

8-{[2-(2-hydroxyethoxy)ethyl]amino}-7-{[3-(2-methoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK525699
SMILES OCCOCCNc1nc2c(n1CC1ON=C(C1)c1ccccc1OC)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 C22H28N6O6 MW 472.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N6O6/c1-26-19-18(20(30)27(2)22(26)31)28(21(24-19)23-8-10-33-11-9-29)13-14-12-16(25-34-14)15-6-4-5-7-17(15)32-3/h4-7,14,29H,8-13H2,1-3H3,(H,23,24)
InChIKey
WETOSMYYEJINCN-UHFFFAOYSA-N
Synonyms

8((2(2hydroxyethoxy)ethyl)amino)7((3(2methoxyphenyl)45dihydro12oxazol5yl)methyl)13dimethyl37dihydro1Hpurine26dione
8((2(2hydroxyethoxy)ethyl)amino)7((3(2methoxyphenyl)45dihydroisoxazol5yl)methyl)13dimethyl1Hpurine26(3H7H)dione
8((2(2HYDROXYETHOXY)ETHYL)AMINO)7((3(2METHOXYPHENYL)45DIHYDROISOXAZOL5YL)METHYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
8(2(2HYDROXYETHOXY)ETHYLAMINO)7((3(2METHOXYPHENYL)45DIHYDRO12OXAZOL5YL)METHYL)13DIMETHYLPURINE26DIONE
8(2(2HYDROXYETHOXY)ETHYLAMINO)7(3(2METHOXYPHENYL)45DIHYDROISOXAZOL5YLMETHYL)13DIMETHYL37DIHYDROPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCOCCO)CC3CC(=NO3)C4=CC=CC=C4OC
InChI=1SC22H28N6O6c1261918(20(30)27(2)22(26)31)28(21(2419)238103311929)13141216(253414)15645717(15)323h471429H813H213H3(H2324)
MFCD01958754
ZINC000009327470
ZINC000009327471

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Available files

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