Vitas-M small molecule compound
8-[benzyl(methyl)amino]-7-(2-chlorobenzyl)-6-hydroxy-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STL047069
SMILES Clc1ccccc1Cn1c(nc2c1c(O)nc(=O)n2C)N(Cc1ccccc1)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 C21H20ClN5O2 MW 409.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O2/c1-25(12-14-8-4-3-5-9-14)20-23-18-17(19(28)24-21(29)26(18)2)27(20)13-15-10-6-7-11-16(15)22/h3-11H,12-13H2,1-2H3,(H,24,28,29)InChIKey
XQDDBLYRQXQRPH-UHFFFAOYSA-NSynonyms
376624-20-3376624203
7((2CHLOROPHENYL)METHYL)3METHYL8(METHYLBENZYLAMINO)137TRIHYDROPURINE26DIONE
8(BENZYL(METHYL)AMINO)7((2CHLOROPHENYL)METHYL)3METHYLPURINE26DIONE
8(BENZYL(METHYL)AMINO)7(2CHLOROBENZYL)3METHYL1HPURINE26(3H7H)DIONE
8(benzyl(methyl)amino)7(2chlorobenzyl)6hydroxy3methyl37dihydro2Hpurin2one
CN1C2=C(C(=O)NC1=O)N(C(=N2)N(C)CC3=CC=CC=C3)CC4=CC=CC=C4Cl
InChI=1SC21H20ClN5O2c125(12148435914)20231817(19(28)2421(29)26(18)2)27(20)131510671116(15)22h311H1213H212H3(H242829)
MFCD03817336
ZINC000000629179
ZINC00629179
ZINC629179
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