Vitas-M small molecule compound
8-[(2-chlorobenzyl)amino]-6-hydroxy-3-methyl-7-(2-methylbenzyl)-3,7-dihydro-2H-purin-2-one
Catalog ID
STL053306
SMILES Cc1ccccc1Cn1c(NCc2ccccc2Cl)nc2c1c(O)nc(=O)n2C
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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/c1-13-7-3-4-9-15(13)12-27-17-18(26(2)21(29)25-19(17)28)24-20(27)23-11-14-8-5-6-10-16(14)22/h3-10H,11-12H2,1-2H3,(H,23,24)(H,25,28,29)InChIKey
QMXDCPKXIVHILM-UHFFFAOYSA-NSynonyms
714233-02-0714233020
8(((2CHLOROPHENYL)METHYL)AMINO)3METHYL7((2METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
8((2CHLOROBENZYL)AMINO)3METHYL7(2METHYLBENZYL)1HPURINE26(3H7H)DIONE
8((2chlorobenzyl)amino)6hydroxy3methyl7(2methylbenzyl)37dihydro2Hpurin2one
8((2CHLOROPHENYL)METHYLAMINO)3METHYL7((2METHYLPHENYL)METHYL)PURINE26DIONE
CC1=CC=CC=C1CN2C3=C(N=C2NCC4=CC=CC=C4Cl)N(C(=O)NC3=O)C
InChI=1SC21H20ClN5O2c113734915(13)12271718(26(2)21(29)2519(17)28)2420(27)2311148561016(14)22h310H1112H212H3(H2324)(H252829)
MFCD05728564
ZINC000001315428
ZINC01315428
ZINC1315428
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