Vitas-M small molecule compound
7-(2-chlorobenzyl)-1,3-dimethyl-8-[(4-methylbenzyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK837936
SMILES Cc1ccc(cc1)CSc1nc2c(n1Cc1ccccc1Cl)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 C22H21ClN4O2S MW 440.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN4O2S/c1-14-8-10-15(11-9-14)13-30-21-24-19-18(20(28)26(3)22(29)25(19)2)27(21)12-16-6-4-5-7-17(16)23/h4-11H,12-13H2,1-3H3InChIKey
UWOFRAABXDCPFI-UHFFFAOYSA-NSynonyms
374607-87-1374607871
7((2CHLOROPHENYL)METHYL)13DIMETHYL8((4METHYLPHENYL)METHYLSULFANYL)PURINE26DIONE
7((2CHLOROPHENYL)METHYL)13DIMETHYL8((4METHYLPHENYL)METHYLTHIO)137TRIHYDROPURINE26DIONE
7(2chlorobenzyl)13dimethyl8((4methylbenzyl)sulfanyl)37dihydro1Hpurine26dione
7(2chlorobenzyl)13dimethyl8((4methylbenzyl)thio)1Hpurine26(3H7H)dione
CC1=CC=C(C=C1)CSC2=NC3=C(N2CC4=CC=CC=C4Cl)C(=O)N(C(=O)N3C)C
InChI=1SC22H21ClN4O2Sc11481015(11914)133021241918(20(28)26(3)22(29)25(19)2)27(21)1216645717(16)23h411H1213H213H3
MFCD01958825
ZINC000005359889
ZINC05359889
ZINC5359889
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