Vitas-M small molecule compound
1-(3-chlorobenzyl)-8-[(2-methoxyethyl)amino]-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK047606
SMILES COCCNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1cccc(c1)Cl
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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 C17H20ClN5O3 MW 377.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20ClN5O3/c1-21-13-14(20-16(21)19-7-8-26-3)22(2)17(25)23(15(13)24)10-11-5-4-6-12(18)9-11/h4-6,9H,7-8,10H2,1-3H3,(H,19,20)InChIKey
QJEHRDYDPABIAC-UHFFFAOYSA-NSynonyms
1((3CHLOROPHENYL)METHYL)8(2METHOXYETHYLAMINO)37DIMETHYLPURINE26DIONE
1(3CHLOROBENZYL)8((2METHOXYETHYL)AMINO)37DIMETHYL37DIHYDRO1HPURINE26DIONE
CN1C2=C(N=C1NCCOC)N(C(=O)N(C2=O)CC3=CC(=CC=C3)Cl)C
COCCNc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1cccc(c1)Cl
InChI=1SC17H20ClN5O3c1211314(2016(21)1978263)22(2)17(25)23(15(13)24)101154612(18)911h469H7810H213H3(H1920)
MFCD02070706
STK047606
ZINC000002488364
ZINC02488364
ZINC2488364
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