Vitas-M small molecule compound
7-(4-chlorobenzyl)-1,3-dimethyl-8-[(2-phenoxyethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK845438
SMILES Clc1ccc(cc1)Cn1c(SCCOc2ccccc2)nc2c1c(=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 C22H21ClN4O3S MW 456.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN4O3S/c1-25-19-18(20(28)26(2)22(25)29)27(14-15-8-10-16(23)11-9-15)21(24-19)31-13-12-30-17-6-4-3-5-7-17/h3-11H,12-14H2,1-2H3InChIKey
AAVHWLZNCBVWAB-UHFFFAOYSA-NSynonyms
510717-42-7510717427
7((4CHLOROPHENYL)METHYL)13DIMETHYL8(2PHENOXYETHYLSULFANYL)PURINE26DIONE
7((4CHLOROPHENYL)METHYL)13DIMETHYL8(2PHENOXYETHYLTHIO)137TRIHYDROPURINE26DIONE
7(4chlorobenzyl)13dimethyl8((2phenoxyethyl)sulfanyl)37dihydro1Hpurine26dione
7(4CHLOROBENZYL)13DIMETHYL8((2PHENOXYETHYL)THIO)1HPURINE26(3H7H)DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCOC3=CC=CC=C3)CC4=CC=C(C=C4)Cl
InChI=1SC22H21ClN4O3Sc1251918(20(28)26(2)22(25)29)27(141581016(23)11915)21(2419)31131230176435717h311H1214H212H3
MFCD03417540
ZINC000013240901
ZINC13240901
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