Vitas-M small molecule compound

8-(benzylamino)-1-(2-chlorobenzyl)-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK832564
SMILES Clc1ccccc1Cn1c(=O)n(C)c2c(c1=O)n(C)c(n2)NCc1ccccc1

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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/c1-25-17-18(24-20(25)23-12-14-8-4-3-5-9-14)26(2)21(29)27(19(17)28)13-15-10-6-7-11-16(15)22/h3-11H,12-13H2,1-2H3,(H,23,24)
InChIKey
ZEARGZZIIWJQPN-UHFFFAOYSA-N
Synonyms
368837-78-9
368837789
8(BENZYLAMINO)1((2CHLOROPHENYL)METHYL)37DIMETHYLPURINE26DIONE
8(BENZYLAMINO)1(2CHLOROBENZYL)37DIMETHYL1HPURINE26(3H7H)DIONE
8(benzylamino)1(2chlorobenzyl)37dimethyl37dihydro1Hpurine26dione
8BENZYLAMINO1(2CHLOROBENZYL)37DIMETHYL37DIHYDROPURINE26DIONE
CN1C2=C(N=C1NCC3=CC=CC=C3)N(C(=O)N(C2=O)CC4=CC=CC=C4Cl)C
InChI=1SC21H20ClN5O2c1251718(2420(25)2312148435914)26(2)21(29)27(19(17)28)131510671116(15)22h311H1213H212H3(H2324)
MFCD01554186
ZINC000001035294
ZINC01035294
ZINC1035294

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Available files

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